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        Module&nbsp;db
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<h1 class="epydoc">Source Code for <a href="p4vasp.db-module.html">Module p4vasp.db</a></h1>
<pre class="py-src">
<a name="L1"></a><tt class="py-lineno">  1</tt>  <tt class="py-line"><tt class="py-comment">#!/usr/bin/python</tt> </tt>
<a name="L2"></a><tt class="py-lineno">  2</tt>  <tt class="py-line"> </tt>
<a name="L3"></a><tt class="py-lineno">  3</tt>  <tt class="py-line"><tt class="py-keyword">from</tt> <tt class="py-name">string</tt> <tt class="py-keyword">import</tt> <tt class="py-op">*</tt> </tt>
<a name="L4"></a><tt class="py-lineno">  4</tt>  <tt class="py-line"><tt class="py-keyword">from</tt> <tt class="py-name">UserList</tt> <tt class="py-keyword">import</tt> <tt class="py-op">*</tt> </tt>
<a name="L5"></a><tt class="py-lineno">  5</tt>  <tt class="py-line"><tt class="py-keyword">from</tt> <tt class="py-name">ConfigParser</tt> <tt class="py-keyword">import</tt> <tt class="py-op">*</tt> </tt>
<a name="L6"></a><tt class="py-lineno">  6</tt>  <tt class="py-line"><tt class="py-keyword">from</tt> <tt class="py-name">os</tt> <tt class="py-keyword">import</tt> <tt class="py-name">mkdir</tt> </tt>
<a name="L7"></a><tt class="py-lineno">  7</tt>  <tt class="py-line"><tt class="py-keyword">import</tt> <tt class="py-name">os</tt><tt class="py-op">.</tt><tt id="link-0" class="py-name" targets="Variable p4vasp.Array.path=p4vasp.Array-module.html#path,Variable p4vasp.Dictionary.path=p4vasp.Dictionary-module.html#path,Variable p4vasp.Structure.path=p4vasp.Structure-module.html#path,Variable p4vasp.applet.Applet.path=p4vasp.applet.Applet-module.html#path,Variable p4vasp.message.path=p4vasp.message-module.html#path,Variable p4vasp.repository.path=p4vasp.repository-module.html#path,Variable p4vasp.schedule'.path=p4vasp.schedule%27-module.html#path,Variable p4vasp.store.path=p4vasp.store-module.html#path,Variable p4vasp.util.path=p4vasp.util-module.html#path"><a title="p4vasp.Array.path
p4vasp.Dictionary.path
p4vasp.Structure.path
p4vasp.applet.Applet.path
p4vasp.message.path
p4vasp.repository.path
p4vasp.schedule'.path
p4vasp.store.path
p4vasp.util.path" class="py-name" href="#" onclick="return doclink('link-0', 'path', 'link-0');">path</a></tt> </tt>
<a name="L8"></a><tt class="py-lineno">  8</tt>  <tt class="py-line"><tt class="py-keyword">from</tt> <tt id="link-1" class="py-name" targets="Package p4vasp=p4vasp-module.html"><a title="p4vasp" class="py-name" href="#" onclick="return doclink('link-1', 'p4vasp', 'link-1');">p4vasp</a></tt> <tt class="py-keyword">import</tt> <tt class="py-op">*</tt> </tt>
<a name="L9"></a><tt class="py-lineno">  9</tt>  <tt class="py-line"><tt class="py-keyword">from</tt> <tt id="link-2" class="py-name"><a title="p4vasp" class="py-name" href="#" onclick="return doclink('link-2', 'p4vasp', 'link-1');">p4vasp</a></tt><tt class="py-op">.</tt><tt id="link-3" class="py-name" targets="Module p4vasp.Structure=p4vasp.Structure-module.html,Class p4vasp.Structure.Structure=p4vasp.Structure.Structure-class.html,Class p4vasp.cStructure.Structure=p4vasp.cStructure.Structure-class.html"><a title="p4vasp.Structure
p4vasp.Structure.Structure
p4vasp.cStructure.Structure" class="py-name" href="#" onclick="return doclink('link-3', 'Structure', 'link-3');">Structure</a></tt> <tt class="py-keyword">import</tt> <tt id="link-4" class="py-name"><a title="p4vasp.Structure
p4vasp.Structure.Structure
p4vasp.cStructure.Structure" class="py-name" href="#" onclick="return doclink('link-4', 'Structure', 'link-3');">Structure</a></tt> </tt>
<a name="L10"></a><tt class="py-lineno"> 10</tt>  <tt class="py-line"><tt class="py-keyword">import</tt> <tt id="link-5" class="py-name"><a title="p4vasp" class="py-name" href="#" onclick="return doclink('link-5', 'p4vasp', 'link-1');">p4vasp</a></tt><tt class="py-op">.</tt><tt id="link-6" class="py-name" targets="Module p4vasp.cStructure=p4vasp.cStructure-module.html"><a title="p4vasp.cStructure" class="py-name" href="#" onclick="return doclink('link-6', 'cStructure', 'link-6');">cStructure</a></tt> </tt>
<a name="L11"></a><tt class="py-lineno"> 11</tt>  <tt class="py-line"><tt class="py-keyword">from</tt> <tt id="link-7" class="py-name"><a title="p4vasp" class="py-name" href="#" onclick="return doclink('link-7', 'p4vasp', 'link-1');">p4vasp</a></tt><tt class="py-op">.</tt><tt id="link-8" class="py-name" targets="Module p4vasp.matrix=p4vasp.matrix-module.html"><a title="p4vasp.matrix" class="py-name" href="#" onclick="return doclink('link-8', 'matrix', 'link-8');">matrix</a></tt> <tt class="py-keyword">import</tt> <tt id="link-9" class="py-name" targets="Class p4vasp.cmatrix.Vector=p4vasp.cmatrix.Vector-class.html,Class p4vasp.matrix.Vector=p4vasp.matrix.Vector-class.html"><a title="p4vasp.cmatrix.Vector
p4vasp.matrix.Vector" class="py-name" href="#" onclick="return doclink('link-9', 'Vector', 'link-9');">Vector</a></tt> </tt>
<a name="L12"></a><tt class="py-lineno"> 12</tt>  <tt class="py-line"> </tt>
<a name="L13"></a><tt class="py-lineno"> 13</tt>  <tt class="py-line"> </tt>
<a name="DBI"></a><div id="DBI-def"><a name="L14"></a><tt class="py-lineno"> 14</tt> <a class="py-toggle" href="#" id="DBI-toggle" onclick="return toggle('DBI');">-</a><tt class="py-line"><tt class="py-keyword">class</tt> <a class="py-def-name" href="p4vasp.db.DBI-class.html">DBI</a><tt class="py-op">:</tt> </tt>
</div><div id="DBI-collapsed" style="display:none;" pad="+++" indent="++++"></div><div id="DBI-expanded"><a name="DBI.__init__"></a><div id="DBI.__init__-def"><a name="L15"></a><tt class="py-lineno"> 15</tt> <a class="py-toggle" href="#" id="DBI.__init__-toggle" onclick="return toggle('DBI.__init__');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBI-class.html#__init__">__init__</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">db</tt><tt class="py-op">=</tt><tt class="py-name">None</tt><tt class="py-op">,</tt><tt class="py-param">name</tt><tt class="py-op">=</tt><tt class="py-name">None</tt><tt class="py-op">,</tt><tt class="py-param">connect</tt><tt class="py-op">=</tt><tt class="py-number">1</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBI.__init__-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBI.__init__-expanded"><a name="L16"></a><tt class="py-lineno"> 16</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-10" class="py-name" targets="Module p4vasp.db=p4vasp.db-module.html"><a title="p4vasp.db" class="py-name" href="#" onclick="return doclink('link-10', 'db', 'link-10');">db</a></tt><tt class="py-op">=</tt><tt id="link-11" class="py-name"><a title="p4vasp.db" class="py-name" href="#" onclick="return doclink('link-11', 'db', 'link-10');">db</a></tt> </tt>
<a name="L17"></a><tt class="py-lineno"> 17</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">blocksize</tt><tt class="py-op">=</tt><tt class="py-number">10</tt> </tt>
<a name="L18"></a><tt class="py-lineno"> 18</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">subst</tt><tt class="py-op">=</tt><tt class="py-op">{</tt><tt class="py-op">}</tt> </tt>
<a name="L19"></a><tt class="py-lineno"> 19</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cfg</tt><tt class="py-op">=</tt><tt class="py-op">{</tt><tt class="py-op">}</tt> </tt>
<a name="L20"></a><tt class="py-lineno"> 20</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-12" class="py-name" targets="Variable p4vasp.applet.Applet.Applet.name=p4vasp.applet.Applet.Applet-class.html#name"><a title="p4vasp.applet.Applet.Applet.name" class="py-name" href="#" onclick="return doclink('link-12', 'name', 'link-12');">name</a></tt><tt class="py-op">=</tt><tt id="link-13" class="py-name"><a title="p4vasp.applet.Applet.Applet.name" class="py-name" href="#" onclick="return doclink('link-13', 'name', 'link-12');">name</a></tt> </tt>
<a name="L21"></a><tt class="py-lineno"> 21</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt id="link-14" class="py-name" targets="Method p4vasp.db.DBI.connect()=p4vasp.db.DBI-class.html#connect,Method p4vasp.db.DBIContainer.connect()=p4vasp.db.DBIContainer-class.html#connect,Method p4vasp.db.MySQLDBI.connect()=p4vasp.db.MySQLDBI-class.html#connect,Method p4vasp.db.SQLiteDBI.connect()=p4vasp.db.SQLiteDBI-class.html#connect"><a title="p4vasp.db.DBI.connect
p4vasp.db.DBIContainer.connect
p4vasp.db.MySQLDBI.connect
p4vasp.db.SQLiteDBI.connect" class="py-name" href="#" onclick="return doclink('link-14', 'connect', 'link-14');">connect</a></tt><tt class="py-op">:</tt> </tt>
<a name="L22"></a><tt class="py-lineno"> 22</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-15" class="py-name"><a title="p4vasp.db.DBI.connect
p4vasp.db.DBIContainer.connect
p4vasp.db.MySQLDBI.connect
p4vasp.db.SQLiteDBI.connect" class="py-name" href="#" onclick="return doclink('link-15', 'connect', 'link-14');">connect</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L23"></a><tt class="py-lineno"> 23</tt>  <tt class="py-line"> </tt>
<a name="L24"></a><tt class="py-lineno"> 24</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt class="py-name">hasattr</tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">,</tt><tt class="py-string">"init"</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L25"></a><tt class="py-lineno"> 25</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-16" class="py-name" targets="Method p4vasp.db.P4VMixin.init()=p4vasp.db.P4VMixin-class.html#init,Method p4vasp.db.UserManagementMixin.init()=p4vasp.db.UserManagementMixin-class.html#init"><a title="p4vasp.db.P4VMixin.init
p4vasp.db.UserManagementMixin.init" class="py-name" href="#" onclick="return doclink('link-16', 'init', 'link-16');">init</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
</div><a name="L26"></a><tt class="py-lineno"> 26</tt>  <tt class="py-line"> </tt>
<a name="L27"></a><tt class="py-lineno"> 27</tt>  <tt class="py-line"> </tt>
<a name="DBI.assure"></a><div id="DBI.assure-def"><a name="L28"></a><tt class="py-lineno"> 28</tt> <a class="py-toggle" href="#" id="DBI.assure-toggle" onclick="return toggle('DBI.assure');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBI-class.html#assure">assure</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">key</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBI.assure-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBI.assure-expanded"><a name="L29"></a><tt class="py-lineno"> 29</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">subst</tt><tt class="py-op">.</tt><tt id="link-17" class="py-name" targets="Method p4vasp.Dictionary.StructuredDictionary.has_key()=p4vasp.Dictionary.StructuredDictionary-class.html#has_key"><a title="p4vasp.Dictionary.StructuredDictionary.has_key" class="py-name" href="#" onclick="return doclink('link-17', 'has_key', 'link-17');">has_key</a></tt><tt class="py-op">(</tt><tt class="py-name">key</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L30"></a><tt class="py-lineno"> 30</tt>  <tt class="py-line">            <tt class="py-keyword">return</tt> <tt class="py-number">1</tt> </tt>
<a name="L31"></a><tt class="py-lineno"> 31</tt>  <tt class="py-line">        <tt class="py-keyword">raise</tt> <tt class="py-name">Exception</tt><tt class="py-op">(</tt><tt class="py-string">"The %s is missing."</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">key</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">:</tt><tt class="py-op">]</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
</div><a name="L32"></a><tt class="py-lineno"> 32</tt>  <tt class="py-line"> </tt>
<a name="DBI.config"></a><div id="DBI.config-def"><a name="L33"></a><tt class="py-lineno"> 33</tt> <a class="py-toggle" href="#" id="DBI.config-toggle" onclick="return toggle('DBI.config');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBI-class.html#config">config</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">c</tt><tt class="py-op">,</tt><tt class="py-param">name</tt><tt class="py-op">=</tt><tt class="py-name">None</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBI.config-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBI.config-expanded"><a name="L34"></a><tt class="py-lineno"> 34</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt id="link-18" class="py-name"><a title="p4vasp.applet.Applet.Applet.name" class="py-name" href="#" onclick="return doclink('link-18', 'name', 'link-12');">name</a></tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L35"></a><tt class="py-lineno"> 35</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-19" class="py-name"><a title="p4vasp.applet.Applet.Applet.name" class="py-name" href="#" onclick="return doclink('link-19', 'name', 'link-12');">name</a></tt><tt class="py-op">=</tt><tt id="link-20" class="py-name"><a title="p4vasp.applet.Applet.Applet.name" class="py-name" href="#" onclick="return doclink('link-20', 'name', 'link-12');">name</a></tt> </tt>
<a name="L36"></a><tt class="py-lineno"> 36</tt>  <tt class="py-line"> </tt>
<a name="L37"></a><tt class="py-lineno"> 37</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cfg</tt><tt class="py-op">.</tt><tt id="link-21" class="py-name" targets="Method p4vasp.Dictionary.StructuredDictionary.update()=p4vasp.Dictionary.StructuredDictionary-class.html#update,Method p4vasp.applet.Applet.GraphApplet.update()=p4vasp.applet.Applet.GraphApplet-class.html#update,Method p4vasp.applet.ElectronicApplet.ElectronicApplet.update()=p4vasp.applet.ElectronicApplet.ElectronicApplet-class.html#update,Method p4vasp.applet.GraphWindowApplet.GraphWindowApplet.update()=p4vasp.applet.GraphWindowApplet.GraphWindowApplet-class.html#update"><a title="p4vasp.Dictionary.StructuredDictionary.update
p4vasp.applet.Applet.GraphApplet.update
p4vasp.applet.ElectronicApplet.ElectronicApplet.update
p4vasp.applet.GraphWindowApplet.GraphWindowApplet.update" class="py-name" href="#" onclick="return doclink('link-21', 'update', 'link-21');">update</a></tt><tt class="py-op">(</tt><tt id="link-22" class="py-name" targets="Variable p4vasp.SystemPM.c=p4vasp.SystemPM-module.html#c"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-22', 'c', 'link-22');">c</a></tt><tt class="py-op">)</tt> </tt>
<a name="L38"></a><tt class="py-lineno"> 38</tt>  <tt class="py-line">        <tt class="py-keyword">for</tt> <tt class="py-name">k</tt><tt class="py-op">,</tt><tt class="py-name">v</tt> <tt class="py-keyword">in</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cfg</tt><tt class="py-op">.</tt><tt id="link-23" class="py-name" targets="Method p4vasp.Dictionary.StructuredDictionary.items()=p4vasp.Dictionary.StructuredDictionary-class.html#items,Method p4vasp.ODPdom.AttributeList.items()=p4vasp.ODPdom.AttributeList-class.html#items,Method p4vasp.ODPdom.NamedNodeMap.items()=p4vasp.ODPdom.NamedNodeMap-class.html#items"><a title="p4vasp.Dictionary.StructuredDictionary.items
p4vasp.ODPdom.AttributeList.items
p4vasp.ODPdom.NamedNodeMap.items" class="py-name" href="#" onclick="return doclink('link-23', 'items', 'link-23');">items</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L39"></a><tt class="py-lineno"> 39</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">lower</tt><tt class="py-op">(</tt><tt class="py-name">k</tt><tt class="py-op">)</tt> <tt class="py-keyword">in</tt> <tt class="py-op">[</tt><tt class="py-string">"user_uid"</tt><tt class="py-op">,</tt><tt class="py-string">"username"</tt><tt class="py-op">]</tt><tt class="py-op">:</tt> </tt>
<a name="L40"></a><tt class="py-lineno"> 40</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">subst</tt><tt class="py-op">[</tt><tt class="py-string">"#"</tt><tt class="py-op">+</tt><tt class="py-name">upper</tt><tt class="py-op">(</tt><tt class="py-name">k</tt><tt class="py-op">)</tt><tt class="py-op">]</tt><tt class="py-op">=</tt><tt class="py-string">'"%s"'</tt><tt class="py-op">%</tt><tt class="py-name">v</tt> </tt>
<a name="L41"></a><tt class="py-lineno"> 41</tt>  <tt class="py-line">                <tt class="py-keyword">continue</tt> </tt>
<a name="L42"></a><tt class="py-lineno"> 42</tt>  <tt class="py-line">            <tt class="py-name">key</tt><tt class="py-op">=</tt><tt class="py-name">None</tt> </tt>
<a name="L43"></a><tt class="py-lineno"> 43</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">lower</tt><tt class="py-op">(</tt><tt class="py-name">k</tt><tt class="py-op">[</tt><tt class="py-op">:</tt><tt class="py-number">7</tt><tt class="py-op">]</tt><tt class="py-op">)</tt><tt class="py-op">==</tt><tt class="py-string">"define_"</tt><tt class="py-op">:</tt> </tt>
<a name="L44"></a><tt class="py-lineno"> 44</tt>  <tt class="py-line">                <tt class="py-name">key</tt><tt class="py-op">=</tt><tt class="py-name">upper</tt><tt class="py-op">(</tt><tt class="py-name">k</tt><tt class="py-op">[</tt><tt class="py-number">7</tt><tt class="py-op">:</tt><tt class="py-op">]</tt><tt class="py-op">)</tt> </tt>
<a name="L45"></a><tt class="py-lineno"> 45</tt>  <tt class="py-line">            <tt class="py-keyword">elif</tt> <tt class="py-name">lower</tt><tt class="py-op">(</tt><tt class="py-name">k</tt><tt class="py-op">[</tt><tt class="py-op">:</tt><tt class="py-number">6</tt><tt class="py-op">]</tt><tt class="py-op">)</tt><tt class="py-op">==</tt><tt class="py-string">"table_"</tt><tt class="py-op">:</tt> </tt>
<a name="L46"></a><tt class="py-lineno"> 46</tt>  <tt class="py-line">                <tt class="py-name">key</tt><tt class="py-op">=</tt><tt class="py-name">upper</tt><tt class="py-op">(</tt><tt class="py-name">k</tt><tt class="py-op">[</tt><tt class="py-number">6</tt><tt class="py-op">:</tt><tt class="py-op">]</tt><tt class="py-op">)</tt> </tt>
<a name="L47"></a><tt class="py-lineno"> 47</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">key</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L48"></a><tt class="py-lineno"> 48</tt>  <tt class="py-line">                <tt class="py-keyword">if</tt> <tt class="py-string">"#"</tt> <tt class="py-keyword">not</tt> <tt class="py-keyword">in</tt> <tt class="py-name">key</tt><tt class="py-op">:</tt> </tt>
<a name="L49"></a><tt class="py-lineno"> 49</tt>  <tt class="py-line">                    <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">subst</tt><tt class="py-op">[</tt><tt class="py-string">"#"</tt><tt class="py-op">+</tt><tt class="py-name">key</tt><tt class="py-op">]</tt><tt class="py-op">=</tt><tt class="py-name">v</tt> </tt>
</div><a name="L50"></a><tt class="py-lineno"> 50</tt>  <tt class="py-line"> </tt>
<a name="L51"></a><tt class="py-lineno"> 51</tt>  <tt class="py-line"> </tt>
<a name="DBI.connect"></a><div id="DBI.connect-def"><a name="L52"></a><tt class="py-lineno"> 52</tt> <a class="py-toggle" href="#" id="DBI.connect-toggle" onclick="return toggle('DBI.connect');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBI-class.html#connect">connect</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBI.connect-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBI.connect-expanded"><a name="L53"></a><tt class="py-lineno"> 53</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-24" class="py-name" targets="Method p4vasp.db.DBI.onConnect()=p4vasp.db.DBI-class.html#onConnect,Method p4vasp.db.UserManagementMixin.onConnect()=p4vasp.db.UserManagementMixin-class.html#onConnect"><a title="p4vasp.db.DBI.onConnect
p4vasp.db.UserManagementMixin.onConnect" class="py-name" href="#" onclick="return doclink('link-24', 'onConnect', 'link-24');">onConnect</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
</div><a name="L54"></a><tt class="py-lineno"> 54</tt>  <tt class="py-line"> </tt>
<a name="DBI.onConnect"></a><div id="DBI.onConnect-def"><a name="L55"></a><tt class="py-lineno"> 55</tt> <a class="py-toggle" href="#" id="DBI.onConnect-toggle" onclick="return toggle('DBI.onConnect');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBI-class.html#onConnect">onConnect</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBI.onConnect-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBI.onConnect-expanded"><a name="L56"></a><tt class="py-lineno"> 56</tt>  <tt class="py-line">        <tt class="py-keyword">pass</tt> </tt>
</div><a name="L57"></a><tt class="py-lineno"> 57</tt>  <tt class="py-line"> </tt>
<a name="DBI.disconnect"></a><div id="DBI.disconnect-def"><a name="L58"></a><tt class="py-lineno"> 58</tt> <a class="py-toggle" href="#" id="DBI.disconnect-toggle" onclick="return toggle('DBI.disconnect');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBI-class.html#disconnect">disconnect</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBI.disconnect-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBI.disconnect-expanded"><a name="L59"></a><tt class="py-lineno"> 59</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-25" class="py-name"><a title="p4vasp.db" class="py-name" href="#" onclick="return doclink('link-25', 'db', 'link-10');">db</a></tt><tt class="py-op">=</tt><tt class="py-name">None</tt> </tt>
<a name="L60"></a><tt class="py-lineno"> 60</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">user_id</tt><tt class="py-op">=</tt><tt class="py-name">None</tt> </tt>
</div><a name="L61"></a><tt class="py-lineno"> 61</tt>  <tt class="py-line"> </tt>
<a name="DBI.isConnected"></a><div id="DBI.isConnected-def"><a name="L62"></a><tt class="py-lineno"> 62</tt> <a class="py-toggle" href="#" id="DBI.isConnected-toggle" onclick="return toggle('DBI.isConnected');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBI-class.html#isConnected">isConnected</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBI.isConnected-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBI.isConnected-expanded"><a name="L63"></a><tt class="py-lineno"> 63</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-26" class="py-name"><a title="p4vasp.db" class="py-name" href="#" onclick="return doclink('link-26', 'db', 'link-10');">db</a></tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt> </tt>
</div><a name="L64"></a><tt class="py-lineno"> 64</tt>  <tt class="py-line"> </tt>
<a name="DBI.subs"></a><div id="DBI.subs-def"><a name="L65"></a><tt class="py-lineno"> 65</tt> <a class="py-toggle" href="#" id="DBI.subs-toggle" onclick="return toggle('DBI.subs');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBI-class.html#subs">subs</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">s</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBI.subs-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBI.subs-expanded"><a name="L66"></a><tt class="py-lineno"> 66</tt>  <tt class="py-line">        <tt id="link-27" class="py-name" targets="Method p4vasp.Dictionary.StructuredDictionary.keys()=p4vasp.Dictionary.StructuredDictionary-class.html#keys,Method p4vasp.ODPdom.AttributeList.keys()=p4vasp.ODPdom.AttributeList-class.html#keys,Method p4vasp.ODPdom.NamedNodeMap.keys()=p4vasp.ODPdom.NamedNodeMap-class.html#keys"><a title="p4vasp.Dictionary.StructuredDictionary.keys
p4vasp.ODPdom.AttributeList.keys
p4vasp.ODPdom.NamedNodeMap.keys" class="py-name" href="#" onclick="return doclink('link-27', 'keys', 'link-27');">keys</a></tt><tt class="py-op">=</tt><tt class="py-name">map</tt><tt class="py-op">(</tt><tt class="py-keyword">lambda</tt> <tt class="py-name">x</tt><tt class="py-op">:</tt><tt class="py-op">(</tt><tt class="py-op">-</tt><tt id="link-28" class="py-name" targets="Method p4vasp.cStructure.Structure.len()=p4vasp.cStructure.Structure-class.html#len"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-28', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">x</tt><tt class="py-op">)</tt><tt class="py-op">,</tt><tt class="py-name">x</tt><tt class="py-op">)</tt><tt class="py-op">,</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">subst</tt><tt class="py-op">.</tt><tt id="link-29" class="py-name"><a title="p4vasp.Dictionary.StructuredDictionary.keys
p4vasp.ODPdom.AttributeList.keys
p4vasp.ODPdom.NamedNodeMap.keys" class="py-name" href="#" onclick="return doclink('link-29', 'keys', 'link-27');">keys</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L67"></a><tt class="py-lineno"> 67</tt>  <tt class="py-line">        <tt id="link-30" class="py-name"><a title="p4vasp.Dictionary.StructuredDictionary.keys
p4vasp.ODPdom.AttributeList.keys
p4vasp.ODPdom.NamedNodeMap.keys" class="py-name" href="#" onclick="return doclink('link-30', 'keys', 'link-27');">keys</a></tt><tt class="py-op">.</tt><tt class="py-name">sort</tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L68"></a><tt class="py-lineno"> 68</tt>  <tt class="py-line">        <tt id="link-31" class="py-name"><a title="p4vasp.Dictionary.StructuredDictionary.keys
p4vasp.ODPdom.AttributeList.keys
p4vasp.ODPdom.NamedNodeMap.keys" class="py-name" href="#" onclick="return doclink('link-31', 'keys', 'link-27');">keys</a></tt><tt class="py-op">=</tt><tt class="py-name">map</tt><tt class="py-op">(</tt><tt class="py-keyword">lambda</tt> <tt class="py-name">x</tt><tt class="py-op">:</tt><tt class="py-name">x</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt id="link-32" class="py-name"><a title="p4vasp.Dictionary.StructuredDictionary.keys
p4vasp.ODPdom.AttributeList.keys
p4vasp.ODPdom.NamedNodeMap.keys" class="py-name" href="#" onclick="return doclink('link-32', 'keys', 'link-27');">keys</a></tt><tt class="py-op">)</tt> </tt>
<a name="L69"></a><tt class="py-lineno"> 69</tt>  <tt class="py-line">        <tt class="py-keyword">for</tt> <tt class="py-name">k</tt> <tt class="py-keyword">in</tt> <tt id="link-33" class="py-name"><a title="p4vasp.Dictionary.StructuredDictionary.keys
p4vasp.ODPdom.AttributeList.keys
p4vasp.ODPdom.NamedNodeMap.keys" class="py-name" href="#" onclick="return doclink('link-33', 'keys', 'link-27');">keys</a></tt><tt class="py-op">:</tt> </tt>
<a name="L70"></a><tt class="py-lineno"> 70</tt>  <tt class="py-line">            <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">replace</tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">,</tt><tt class="py-name">k</tt><tt class="py-op">,</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">subst</tt><tt class="py-op">[</tt><tt class="py-name">k</tt><tt class="py-op">]</tt><tt class="py-op">)</tt> </tt>
<a name="L71"></a><tt class="py-lineno"> 71</tt>  <tt class="py-line"><tt class="py-comment">#    print s</tt> </tt>
<a name="L72"></a><tt class="py-lineno"> 72</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-name">s</tt> </tt>
</div><a name="L73"></a><tt class="py-lineno"> 73</tt>  <tt class="py-line"> </tt>
<a name="DBI.exe"></a><div id="DBI.exe-def"><a name="L74"></a><tt class="py-lineno"> 74</tt> <a class="py-toggle" href="#" id="DBI.exe-toggle" onclick="return toggle('DBI.exe');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBI-class.html#exe">exe</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">s</tt><tt class="py-op">,</tt><tt class="py-param">ignore_errors</tt><tt class="py-op">=</tt><tt class="py-number">0</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBI.exe-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBI.exe-expanded"><a name="L75"></a><tt class="py-lineno"> 75</tt>  <tt class="py-line">        <tt class="py-keyword">try</tt><tt class="py-op">:</tt> </tt>
<a name="L76"></a><tt class="py-lineno"> 76</tt>  <tt class="py-line">            <tt id="link-34" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-34', 'c', 'link-22');">c</a></tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-35" class="py-name"><a title="p4vasp.db" class="py-name" href="#" onclick="return doclink('link-35', 'db', 'link-10');">db</a></tt><tt class="py-op">.</tt><tt class="py-name">cursor</tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L77"></a><tt class="py-lineno"> 77</tt>  <tt class="py-line">            <tt id="link-36" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-36', 'c', 'link-22');">c</a></tt><tt class="py-op">.</tt><tt class="py-name">execute</tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-37" class="py-name" targets="Method p4vasp.db.DBI.subs()=p4vasp.db.DBI-class.html#subs"><a title="p4vasp.db.DBI.subs" class="py-name" href="#" onclick="return doclink('link-37', 'subs', 'link-37');">subs</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L78"></a><tt class="py-lineno"> 78</tt>  <tt class="py-line">        <tt class="py-keyword">except</tt><tt class="py-op">:</tt> </tt>
<a name="L79"></a><tt class="py-lineno"> 79</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-keyword">not</tt> <tt class="py-name">ignore_errors</tt><tt class="py-op">:</tt> </tt>
<a name="L80"></a><tt class="py-lineno"> 80</tt>  <tt class="py-line">                <tt class="py-keyword">raise</tt> </tt>
</div><a name="L81"></a><tt class="py-lineno"> 81</tt>  <tt class="py-line"> </tt>
<a name="L82"></a><tt class="py-lineno"> 82</tt>  <tt class="py-line"> </tt>
<a name="DBI.fetchall"></a><div id="DBI.fetchall-def"><a name="L83"></a><tt class="py-lineno"> 83</tt> <a class="py-toggle" href="#" id="DBI.fetchall-toggle" onclick="return toggle('DBI.fetchall');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBI-class.html#fetchall">fetchall</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">s</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBI.fetchall-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBI.fetchall-expanded"><a name="L84"></a><tt class="py-lineno"> 84</tt>  <tt class="py-line">        <tt id="link-38" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-38', 'c', 'link-22');">c</a></tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-39" class="py-name"><a title="p4vasp.db" class="py-name" href="#" onclick="return doclink('link-39', 'db', 'link-10');">db</a></tt><tt class="py-op">.</tt><tt class="py-name">cursor</tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L85"></a><tt class="py-lineno"> 85</tt>  <tt class="py-line">        <tt id="link-40" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-40', 'c', 'link-22');">c</a></tt><tt class="py-op">.</tt><tt class="py-name">execute</tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-41" class="py-name"><a title="p4vasp.db.DBI.subs" class="py-name" href="#" onclick="return doclink('link-41', 'subs', 'link-37');">subs</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L86"></a><tt class="py-lineno"> 86</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt id="link-42" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-42', 'c', 'link-22');">c</a></tt><tt class="py-op">.</tt><tt id="link-43" class="py-name" targets="Method p4vasp.db.DBI.fetchall()=p4vasp.db.DBI-class.html#fetchall"><a title="p4vasp.db.DBI.fetchall" class="py-name" href="#" onclick="return doclink('link-43', 'fetchall', 'link-43');">fetchall</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
</div><a name="L87"></a><tt class="py-lineno"> 87</tt>  <tt class="py-line"> </tt>
<a name="DBI.fetchone"></a><div id="DBI.fetchone-def"><a name="L88"></a><tt class="py-lineno"> 88</tt> <a class="py-toggle" href="#" id="DBI.fetchone-toggle" onclick="return toggle('DBI.fetchone');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBI-class.html#fetchone">fetchone</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">s</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBI.fetchone-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBI.fetchone-expanded"><a name="L89"></a><tt class="py-lineno"> 89</tt>  <tt class="py-line">        <tt id="link-44" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-44', 'c', 'link-22');">c</a></tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-45" class="py-name"><a title="p4vasp.db" class="py-name" href="#" onclick="return doclink('link-45', 'db', 'link-10');">db</a></tt><tt class="py-op">.</tt><tt class="py-name">cursor</tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L90"></a><tt class="py-lineno"> 90</tt>  <tt class="py-line">        <tt id="link-46" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-46', 'c', 'link-22');">c</a></tt><tt class="py-op">.</tt><tt class="py-name">execute</tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-47" class="py-name"><a title="p4vasp.db.DBI.subs" class="py-name" href="#" onclick="return doclink('link-47', 'subs', 'link-37');">subs</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L91"></a><tt class="py-lineno"> 91</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt id="link-48" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-48', 'c', 'link-22');">c</a></tt><tt class="py-op">.</tt><tt id="link-49" class="py-name" targets="Method p4vasp.db.DBI.fetchone()=p4vasp.db.DBI-class.html#fetchone,Method p4vasp.db.DBIContainer.fetchone()=p4vasp.db.DBIContainer-class.html#fetchone"><a title="p4vasp.db.DBI.fetchone
p4vasp.db.DBIContainer.fetchone" class="py-name" href="#" onclick="return doclink('link-49', 'fetchone', 'link-49');">fetchone</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
</div><a name="L92"></a><tt class="py-lineno"> 92</tt>  <tt class="py-line"> </tt>
<a name="DBI.fetchiter"></a><div id="DBI.fetchiter-def"><a name="L93"></a><tt class="py-lineno"> 93</tt> <a class="py-toggle" href="#" id="DBI.fetchiter-toggle" onclick="return toggle('DBI.fetchiter');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBI-class.html#fetchiter">fetchiter</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">s</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBI.fetchiter-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBI.fetchiter-expanded"><a name="L94"></a><tt class="py-lineno"> 94</tt>  <tt class="py-line">        <tt id="link-50" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-50', 'c', 'link-22');">c</a></tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-51" class="py-name"><a title="p4vasp.db" class="py-name" href="#" onclick="return doclink('link-51', 'db', 'link-10');">db</a></tt><tt class="py-op">.</tt><tt class="py-name">cursor</tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L95"></a><tt class="py-lineno"> 95</tt>  <tt class="py-line">        <tt id="link-52" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-52', 'c', 'link-22');">c</a></tt><tt class="py-op">.</tt><tt class="py-name">execute</tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-53" class="py-name"><a title="p4vasp.db.DBI.subs" class="py-name" href="#" onclick="return doclink('link-53', 'subs', 'link-37');">subs</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L96"></a><tt class="py-lineno"> 96</tt>  <tt class="py-line">        <tt class="py-keyword">while</tt> <tt class="py-number">1</tt><tt class="py-op">:</tt> </tt>
<a name="L97"></a><tt class="py-lineno"> 97</tt>  <tt class="py-line">            <tt class="py-name">d</tt><tt class="py-op">=</tt><tt id="link-54" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-54', 'c', 'link-22');">c</a></tt><tt class="py-op">.</tt><tt id="link-55" class="py-name"><a title="p4vasp.db.DBI.fetchone
p4vasp.db.DBIContainer.fetchone" class="py-name" href="#" onclick="return doclink('link-55', 'fetchone', 'link-49');">fetchone</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L98"></a><tt class="py-lineno"> 98</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">d</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L99"></a><tt class="py-lineno"> 99</tt>  <tt class="py-line">                <tt class="py-keyword">yield</tt> <tt class="py-name">d</tt> </tt>
<a name="L100"></a><tt class="py-lineno">100</tt>  <tt class="py-line">            <tt class="py-keyword">else</tt><tt class="py-op">:</tt> </tt>
<a name="L101"></a><tt class="py-lineno">101</tt>  <tt class="py-line">                <tt class="py-keyword">break</tt> </tt>
</div><a name="L102"></a><tt class="py-lineno">102</tt>  <tt class="py-line"> </tt>
<a name="DBI.fetchvalue"></a><div id="DBI.fetchvalue-def"><a name="L103"></a><tt class="py-lineno">103</tt> <a class="py-toggle" href="#" id="DBI.fetchvalue-toggle" onclick="return toggle('DBI.fetchvalue');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBI-class.html#fetchvalue">fetchvalue</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">s</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBI.fetchvalue-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBI.fetchvalue-expanded"><a name="L104"></a><tt class="py-lineno">104</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-56" class="py-name"><a title="p4vasp.db.DBI.fetchone
p4vasp.db.DBIContainer.fetchone" class="py-name" href="#" onclick="return doclink('link-56', 'fetchone', 'link-49');">fetchone</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt> </tt>
</div><a name="DBI.fetchvalues"></a><div id="DBI.fetchvalues-def"><a name="L105"></a><tt class="py-lineno">105</tt> <a class="py-toggle" href="#" id="DBI.fetchvalues-toggle" onclick="return toggle('DBI.fetchvalues');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBI-class.html#fetchvalues">fetchvalues</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">s</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBI.fetchvalues-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBI.fetchvalues-expanded"><a name="L106"></a><tt class="py-lineno">106</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-name">map</tt><tt class="py-op">(</tt><tt class="py-keyword">lambda</tt> <tt class="py-name">x</tt><tt class="py-op">:</tt><tt class="py-name">x</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-57" class="py-name"><a title="p4vasp.db.DBI.fetchall" class="py-name" href="#" onclick="return doclink('link-57', 'fetchall', 'link-43');">fetchall</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
</div><a name="L107"></a><tt class="py-lineno">107</tt>  <tt class="py-line"> </tt>
<a name="DBI.run"></a><div id="DBI.run-def"><a name="L108"></a><tt class="py-lineno">108</tt> <a class="py-toggle" href="#" id="DBI.run-toggle" onclick="return toggle('DBI.run');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBI-class.html#run">run</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">s</tt><tt class="py-op">,</tt><tt class="py-param">ignore_errors</tt><tt class="py-op">=</tt><tt class="py-number">0</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBI.run-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBI.run-expanded"><a name="L109"></a><tt class="py-lineno">109</tt>  <tt class="py-line">        <tt class="py-keyword">for</tt> <tt class="py-name">ss</tt> <tt class="py-keyword">in</tt> <tt class="py-name">split</tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">,</tt><tt class="py-string">";"</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L110"></a><tt class="py-lineno">110</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-58" class="py-name" targets="Method p4vasp.db.DBI.exe()=p4vasp.db.DBI-class.html#exe,Method p4vasp.db.DBIContainer.exe()=p4vasp.db.DBIContainer-class.html#exe"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-58', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-name">ss</tt><tt class="py-op">,</tt><tt class="py-name">ignore_errors</tt><tt class="py-op">=</tt><tt class="py-name">ignore_errors</tt><tt class="py-op">)</tt> </tt>
</div><a name="L111"></a><tt class="py-lineno">111</tt>  <tt class="py-line"> </tt>
<a name="DBI.runfile"></a><div id="DBI.runfile-def"><a name="L112"></a><tt class="py-lineno">112</tt> <a class="py-toggle" href="#" id="DBI.runfile-toggle" onclick="return toggle('DBI.runfile');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBI-class.html#runfile">runfile</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">f</tt><tt class="py-op">,</tt><tt class="py-param">ignore_errors</tt><tt class="py-op">=</tt><tt class="py-number">0</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBI.runfile-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBI.runfile-expanded"><a name="L113"></a><tt class="py-lineno">113</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt class="py-name">type</tt><tt class="py-op">(</tt><tt class="py-name">f</tt><tt class="py-op">)</tt><tt class="py-op">==</tt><tt class="py-name">type</tt><tt class="py-op">(</tt><tt class="py-string">""</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L114"></a><tt class="py-lineno">114</tt>  <tt class="py-line">            <tt class="py-name">f</tt><tt class="py-op">=</tt><tt class="py-name">open</tt><tt class="py-op">(</tt><tt class="py-name">f</tt><tt class="py-op">,</tt><tt class="py-string">"r"</tt><tt class="py-op">)</tt> </tt>
<a name="L115"></a><tt class="py-lineno">115</tt>  <tt class="py-line">        <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">f</tt><tt class="py-op">.</tt><tt id="link-59" class="py-name" targets="Method p4vasp.Dictionary.Incar.read()=p4vasp.Dictionary.Incar-class.html#read,Method p4vasp.GraphPM.GraphProperty.read()=p4vasp.GraphPM.GraphProperty-class.html#read,Method p4vasp.Property.Property.read()=p4vasp.Property.Property-class.html#read,Method p4vasp.Structure.Structure.read()=p4vasp.Structure.Structure-class.html#read,Method p4vasp.cStructure.Structure.read()=p4vasp.cStructure.Structure-class.html#read,Method p4vasp.util.Parseable.read()=p4vasp.util.Parseable-class.html#read"><a title="p4vasp.Dictionary.Incar.read
p4vasp.GraphPM.GraphProperty.read
p4vasp.Property.Property.read
p4vasp.Structure.Structure.read
p4vasp.cStructure.Structure.read
p4vasp.util.Parseable.read" class="py-name" href="#" onclick="return doclink('link-59', 'read', 'link-59');">read</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L116"></a><tt class="py-lineno">116</tt>  <tt class="py-line">        <tt class="py-name">f</tt><tt class="py-op">.</tt><tt id="link-60" class="py-name" targets="Method p4vasp.GraphCanvas.GraphCanvasWindow.close()=p4vasp.GraphCanvas.GraphCanvasWindow-class.html#close,Method p4vasp.GraphCanvas_gtk1.GraphCanvasWindow.close()=p4vasp.GraphCanvas_gtk1.GraphCanvasWindow-class.html#close,Method p4vasp.message.DummyFile.close()=p4vasp.message.DummyFile-class.html#close,Method p4vasp.message.PrintFile.close()=p4vasp.message.PrintFile-class.html#close"><a title="p4vasp.GraphCanvas.GraphCanvasWindow.close
p4vasp.GraphCanvas_gtk1.GraphCanvasWindow.close
p4vasp.message.DummyFile.close
p4vasp.message.PrintFile.close" class="py-name" href="#" onclick="return doclink('link-60', 'close', 'link-60');">close</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L117"></a><tt class="py-lineno">117</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-61" class="py-name" targets="Method p4vasp.db.DBI.run()=p4vasp.db.DBI-class.html#run,Method p4vasp.db.DBIContainer.run()=p4vasp.db.DBIContainer-class.html#run,Method p4vasp.schedule'.Scheduler.run()=p4vasp.schedule%27.Scheduler-class.html#run"><a title="p4vasp.db.DBI.run
p4vasp.db.DBIContainer.run
p4vasp.schedule'.Scheduler.run" class="py-name" href="#" onclick="return doclink('link-61', 'run', 'link-61');">run</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">,</tt><tt class="py-name">ignore_errors</tt><tt class="py-op">)</tt> </tt>
</div><a name="L118"></a><tt class="py-lineno">118</tt>  <tt class="py-line"> </tt>
<a name="DBI.insertRecord"></a><div id="DBI.insertRecord-def"><a name="L119"></a><tt class="py-lineno">119</tt> <a class="py-toggle" href="#" id="DBI.insertRecord-toggle" onclick="return toggle('DBI.insertRecord');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBI-class.html#insertRecord">insertRecord</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">table</tt><tt class="py-op">,</tt><tt class="py-param">indexname</tt><tt class="py-op">,</tt><tt class="py-param">keys</tt><tt class="py-op">,</tt><tt class="py-param">values</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBI.insertRecord-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBI.insertRecord-expanded"><a name="L120"></a><tt class="py-lineno">120</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-62" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-62', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">"INSERT INTO %s (%s) VALUES (%s)"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">table</tt><tt class="py-op">,</tt><tt id="link-63" class="py-name"><a title="p4vasp.Dictionary.StructuredDictionary.keys
p4vasp.ODPdom.AttributeList.keys
p4vasp.ODPdom.NamedNodeMap.keys" class="py-name" href="#" onclick="return doclink('link-63', 'keys', 'link-27');">keys</a></tt><tt class="py-op">,</tt><tt id="link-64" class="py-name" targets="Method p4vasp.Dictionary.StructuredDictionary.values()=p4vasp.Dictionary.StructuredDictionary-class.html#values,Method p4vasp.ODPdom.AttributeList.values()=p4vasp.ODPdom.AttributeList-class.html#values,Method p4vasp.ODPdom.NamedNodeMap.values()=p4vasp.ODPdom.NamedNodeMap-class.html#values"><a title="p4vasp.Dictionary.StructuredDictionary.values
p4vasp.ODPdom.AttributeList.values
p4vasp.ODPdom.NamedNodeMap.values" class="py-name" href="#" onclick="return doclink('link-64', 'values', 'link-64');">values</a></tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L121"></a><tt class="py-lineno">121</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-65" class="py-name" targets="Method p4vasp.db.DBI.fetchvalue()=p4vasp.db.DBI-class.html#fetchvalue,Method p4vasp.db.DBIContainer.fetchvalue()=p4vasp.db.DBIContainer-class.html#fetchvalue"><a title="p4vasp.db.DBI.fetchvalue
p4vasp.db.DBIContainer.fetchvalue" class="py-name" href="#" onclick="return doclink('link-65', 'fetchvalue', 'link-65');">fetchvalue</a></tt><tt class="py-op">(</tt><tt class="py-string">"SELECT MAX(%s) FROM %s"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">indexname</tt><tt class="py-op">,</tt><tt class="py-name">table</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
</div><a name="L122"></a><tt class="py-lineno">122</tt>  <tt class="py-line"> </tt>
<a name="DBI.commit"></a><div id="DBI.commit-def"><a name="L123"></a><tt class="py-lineno">123</tt> <a class="py-toggle" href="#" id="DBI.commit-toggle" onclick="return toggle('DBI.commit');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBI-class.html#commit">commit</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBI.commit-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBI.commit-expanded"><a name="L124"></a><tt class="py-lineno">124</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-66" class="py-name"><a title="p4vasp.db" class="py-name" href="#" onclick="return doclink('link-66', 'db', 'link-10');">db</a></tt><tt class="py-op">.</tt><tt id="link-67" class="py-name" targets="Method p4vasp.db.DBI.commit()=p4vasp.db.DBI-class.html#commit,Method p4vasp.db.DBIContainer.commit()=p4vasp.db.DBIContainer-class.html#commit,Method p4vasp.db.MySQLDBI.commit()=p4vasp.db.MySQLDBI-class.html#commit"><a title="p4vasp.db.DBI.commit
p4vasp.db.DBIContainer.commit
p4vasp.db.MySQLDBI.commit" class="py-name" href="#" onclick="return doclink('link-67', 'commit', 'link-67');">commit</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
</div></div><a name="L125"></a><tt class="py-lineno">125</tt>  <tt class="py-line"> </tt>
<a name="L126"></a><tt class="py-lineno">126</tt>  <tt class="py-line"> </tt>
<a name="L127"></a><tt class="py-lineno">127</tt>  <tt class="py-line"> </tt>
<a name="Query"></a><div id="Query-def"><a name="L128"></a><tt class="py-lineno">128</tt> <a class="py-toggle" href="#" id="Query-toggle" onclick="return toggle('Query');">-</a><tt class="py-line"><tt class="py-keyword">class</tt> <a class="py-def-name" href="p4vasp.db.Query-class.html">Query</a><tt class="py-op">:</tt> </tt>
</div><div id="Query-collapsed" style="display:none;" pad="+++" indent="++++"></div><div id="Query-expanded"><a name="Query.__init__"></a><div id="Query.__init__-def"><a name="L129"></a><tt class="py-lineno">129</tt> <a class="py-toggle" href="#" id="Query.__init__-toggle" onclick="return toggle('Query.__init__');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.Query-class.html#__init__">__init__</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">container</tt><tt class="py-op">,</tt><tt class="py-param">data</tt><tt class="py-op">,</tt><tt class="py-param">fromstatement</tt><tt class="py-op">,</tt><tt class="py-param">condition</tt><tt class="py-op">,</tt><tt class="py-param">cachesize</tt><tt class="py-op">=</tt><tt class="py-number">200</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="Query.__init__-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="Query.__init__-expanded"><a name="L130"></a><tt class="py-lineno">130</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">container</tt>     <tt class="py-op">=</tt> <tt class="py-name">container</tt> </tt>
<a name="L131"></a><tt class="py-lineno">131</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-68" class="py-name" targets="Module p4vasp.paint3d.data=p4vasp.paint3d.data-module.html"><a title="p4vasp.paint3d.data" class="py-name" href="#" onclick="return doclink('link-68', 'data', 'link-68');">data</a></tt>          <tt class="py-op">=</tt> <tt id="link-69" class="py-name"><a title="p4vasp.paint3d.data" class="py-name" href="#" onclick="return doclink('link-69', 'data', 'link-68');">data</a></tt> </tt>
<a name="L132"></a><tt class="py-lineno">132</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">fromstatement</tt> <tt class="py-op">=</tt> <tt class="py-name">fromstatement</tt> </tt>
<a name="L133"></a><tt class="py-lineno">133</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">condition</tt>     <tt class="py-op">=</tt> <tt class="py-name">condition</tt> </tt>
<a name="L134"></a><tt class="py-lineno">134</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cachesize</tt>     <tt class="py-op">=</tt> <tt class="py-name">cachesize</tt> </tt>
<a name="L135"></a><tt class="py-lineno">135</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-70" class="py-name" targets="Method p4vasp.db.Query.refresh()=p4vasp.db.Query-class.html#refresh"><a title="p4vasp.db.Query.refresh" class="py-name" href="#" onclick="return doclink('link-70', 'refresh', 'link-70');">refresh</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
</div><a name="L136"></a><tt class="py-lineno">136</tt>  <tt class="py-line"> </tt>
<a name="Query.__len__"></a><div id="Query.__len__-def"><a name="L137"></a><tt class="py-lineno">137</tt> <a class="py-toggle" href="#" id="Query.__len__-toggle" onclick="return toggle('Query.__len__');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.Query-class.html#__len__">__len__</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="Query.__len__-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="Query.__len__-expanded"><a name="L138"></a><tt class="py-lineno">138</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-name">int</tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cumulative</tt><tt class="py-op">[</tt><tt class="py-op">-</tt><tt class="py-number">1</tt><tt class="py-op">]</tt><tt class="py-op">)</tt> </tt>
</div><a name="L139"></a><tt class="py-lineno">139</tt>  <tt class="py-line"> </tt>
<a name="Query.refresh"></a><div id="Query.refresh-def"><a name="L140"></a><tt class="py-lineno">140</tt> <a class="py-toggle" href="#" id="Query.refresh-toggle" onclick="return toggle('Query.refresh');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.Query-class.html#refresh">refresh</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="Query.refresh-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="Query.refresh-expanded"><a name="L141"></a><tt class="py-lineno">141</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cache</tt>      <tt class="py-op">=</tt> <tt class="py-op">[</tt><tt class="py-op">]</tt> </tt>
<a name="L142"></a><tt class="py-lineno">142</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">hash</tt>       <tt class="py-op">=</tt> <tt class="py-op">{</tt><tt class="py-op">}</tt> </tt>
<a name="L143"></a><tt class="py-lineno">143</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-71" class="py-name" targets="Method p4vasp.db.Query.count()=p4vasp.db.Query-class.html#count"><a title="p4vasp.db.Query.count" class="py-name" href="#" onclick="return doclink('link-71', 'count', 'link-71');">count</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
</div><a name="L144"></a><tt class="py-lineno">144</tt>  <tt class="py-line"> </tt>
<a name="Query.finddb"></a><div id="Query.finddb-def"><a name="L145"></a><tt class="py-lineno">145</tt> <a class="py-toggle" href="#" id="Query.finddb-toggle" onclick="return toggle('Query.finddb');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.Query-class.html#finddb">finddb</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">i</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="Query.finddb-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="Query.finddb-expanded"><a name="L146"></a><tt class="py-lineno">146</tt>  <tt class="py-line">        <tt class="py-keyword">for</tt> <tt class="py-name">j</tt> <tt class="py-keyword">in</tt> <tt class="py-name">xrange</tt><tt class="py-op">(</tt><tt id="link-72" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-72', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cumulative</tt><tt class="py-op">)</tt><tt class="py-op">-</tt><tt class="py-number">1</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L147"></a><tt class="py-lineno">147</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cumulative</tt><tt class="py-op">[</tt><tt class="py-name">j</tt><tt class="py-op">]</tt><tt class="py-op">&lt;=</tt><tt id="link-73" class="py-name" targets="Variable p4vasp.paint3d.OpenGLPaint3D.i=p4vasp.paint3d.OpenGLPaint3D-module.html#i"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-73', 'i', 'link-73');">i</a></tt> <tt class="py-keyword">and</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cumulative</tt><tt class="py-op">[</tt><tt class="py-name">j</tt><tt class="py-op">+</tt><tt class="py-number">1</tt><tt class="py-op">]</tt><tt class="py-op">&gt;</tt><tt id="link-74" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-74', 'i', 'link-73');">i</a></tt><tt class="py-op">:</tt> </tt>
<a name="L148"></a><tt class="py-lineno">148</tt>  <tt class="py-line">                <tt class="py-keyword">return</tt> <tt class="py-name">j</tt> </tt>
</div><a name="L149"></a><tt class="py-lineno">149</tt>  <tt class="py-line"> </tt>
<a name="Query.shrinkCache"></a><div id="Query.shrinkCache-def"><a name="L150"></a><tt class="py-lineno">150</tt> <a class="py-toggle" href="#" id="Query.shrinkCache-toggle" onclick="return toggle('Query.shrinkCache');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.Query-class.html#shrinkCache">shrinkCache</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">n</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="Query.shrinkCache-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="Query.shrinkCache-expanded"><a name="L151"></a><tt class="py-lineno">151</tt>  <tt class="py-line">        <tt class="py-docstring">"Remove (up to) n elements from the cache."</tt> </tt>
<a name="L152"></a><tt class="py-lineno">152</tt>  <tt class="py-line">        <tt id="link-75" class="py-name" targets="Variable p4vasp.cmatrix.Matrix.n=p4vasp.cmatrix.Matrix-class.html#n,Variable p4vasp.paint3d.OpenGLPaint3D.BasicOpenGLPaint3D.n=p4vasp.paint3d.OpenGLPaint3D.BasicOpenGLPaint3D-class.html#n"><a title="p4vasp.cmatrix.Matrix.n
p4vasp.paint3d.OpenGLPaint3D.BasicOpenGLPaint3D.n" class="py-name" href="#" onclick="return doclink('link-75', 'n', 'link-75');">n</a></tt><tt class="py-op">=</tt><tt class="py-name">min</tt><tt class="py-op">(</tt><tt id="link-76" class="py-name"><a title="p4vasp.cmatrix.Matrix.n
p4vasp.paint3d.OpenGLPaint3D.BasicOpenGLPaint3D.n" class="py-name" href="#" onclick="return doclink('link-76', 'n', 'link-75');">n</a></tt><tt class="py-op">,</tt><tt id="link-77" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-77', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cache</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L153"></a><tt class="py-lineno">153</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt id="link-78" class="py-name"><a title="p4vasp.cmatrix.Matrix.n
p4vasp.paint3d.OpenGLPaint3D.BasicOpenGLPaint3D.n" class="py-name" href="#" onclick="return doclink('link-78', 'n', 'link-75');">n</a></tt><tt class="py-op">&gt;</tt><tt class="py-number">0</tt><tt class="py-op">:</tt> </tt>
<a name="L154"></a><tt class="py-lineno">154</tt>  <tt class="py-line">            <tt class="py-keyword">del</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cache</tt><tt class="py-op">[</tt><tt class="py-op">:</tt><tt id="link-79" class="py-name"><a title="p4vasp.cmatrix.Matrix.n
p4vasp.paint3d.OpenGLPaint3D.BasicOpenGLPaint3D.n" class="py-name" href="#" onclick="return doclink('link-79', 'n', 'link-75');">n</a></tt><tt class="py-op">]</tt> </tt>
<a name="L155"></a><tt class="py-lineno">155</tt>  <tt class="py-line"> </tt>
<a name="L156"></a><tt class="py-lineno">156</tt>  <tt class="py-line">            <tt class="py-keyword">for</tt> <tt class="py-name">k</tt><tt class="py-op">,</tt><tt class="py-name">v</tt> <tt class="py-keyword">in</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">hash</tt><tt class="py-op">.</tt><tt id="link-80" class="py-name"><a title="p4vasp.Dictionary.StructuredDictionary.items
p4vasp.ODPdom.AttributeList.items
p4vasp.ODPdom.NamedNodeMap.items" class="py-name" href="#" onclick="return doclink('link-80', 'items', 'link-23');">items</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L157"></a><tt class="py-lineno">157</tt>  <tt class="py-line">                <tt class="py-keyword">if</tt> <tt class="py-name">v</tt><tt class="py-op">&lt;</tt><tt id="link-81" class="py-name"><a title="p4vasp.cmatrix.Matrix.n
p4vasp.paint3d.OpenGLPaint3D.BasicOpenGLPaint3D.n" class="py-name" href="#" onclick="return doclink('link-81', 'n', 'link-75');">n</a></tt><tt class="py-op">:</tt> </tt>
<a name="L158"></a><tt class="py-lineno">158</tt>  <tt class="py-line">                    <tt class="py-keyword">del</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">hash</tt><tt class="py-op">[</tt><tt class="py-name">k</tt><tt class="py-op">]</tt> </tt>
<a name="L159"></a><tt class="py-lineno">159</tt>  <tt class="py-line">                <tt class="py-keyword">else</tt><tt class="py-op">:</tt> </tt>
<a name="L160"></a><tt class="py-lineno">160</tt>  <tt class="py-line">                    <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">hash</tt><tt class="py-op">[</tt><tt class="py-name">k</tt><tt class="py-op">]</tt><tt class="py-op">=</tt><tt class="py-name">v</tt><tt class="py-op">-</tt><tt id="link-82" class="py-name"><a title="p4vasp.cmatrix.Matrix.n
p4vasp.paint3d.OpenGLPaint3D.BasicOpenGLPaint3D.n" class="py-name" href="#" onclick="return doclink('link-82', 'n', 'link-75');">n</a></tt> </tt>
</div><a name="L161"></a><tt class="py-lineno">161</tt>  <tt class="py-line"> </tt>
<a name="Query.addToCache"></a><div id="Query.addToCache-def"><a name="L162"></a><tt class="py-lineno">162</tt> <a class="py-toggle" href="#" id="Query.addToCache-toggle" onclick="return toggle('Query.addToCache');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.Query-class.html#addToCache">addToCache</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">i</tt><tt class="py-op">,</tt><tt class="py-param">r</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="Query.addToCache-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="Query.addToCache-expanded"><a name="L163"></a><tt class="py-lineno">163</tt>  <tt class="py-line">        <tt class="py-name">v</tt><tt class="py-op">=</tt><tt id="link-83" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-83', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cache</tt><tt class="py-op">)</tt> </tt>
<a name="L164"></a><tt class="py-lineno">164</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cache</tt><tt class="py-op">.</tt><tt id="link-84" class="py-name" targets="Method p4vasp.Structure.AtomInfo.append()=p4vasp.Structure.AtomInfo-class.html#append,Method p4vasp.Structure.Structure.append()=p4vasp.Structure.Structure-class.html#append,Method p4vasp.cStructure.AtomInfo.append()=p4vasp.cStructure.AtomInfo-class.html#append,Method p4vasp.cStructure.Structure.append()=p4vasp.cStructure.Structure-class.html#append,Method p4vasp.graph.Graph.append()=p4vasp.graph.Graph-class.html#append,Method p4vasp.graph.World.append()=p4vasp.graph.World-class.html#append,Method p4vasp.repository.Repository.append()=p4vasp.repository.Repository-class.html#append"><a title="p4vasp.Structure.AtomInfo.append
p4vasp.Structure.Structure.append
p4vasp.cStructure.AtomInfo.append
p4vasp.cStructure.Structure.append
p4vasp.graph.Graph.append
p4vasp.graph.World.append
p4vasp.repository.Repository.append" class="py-name" href="#" onclick="return doclink('link-84', 'append', 'link-84');">append</a></tt><tt class="py-op">(</tt><tt class="py-name">r</tt><tt class="py-op">)</tt> </tt>
<a name="L165"></a><tt class="py-lineno">165</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">hash</tt><tt class="py-op">[</tt><tt id="link-85" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-85', 'i', 'link-73');">i</a></tt><tt class="py-op">]</tt><tt class="py-op">=</tt><tt class="py-name">v</tt> </tt>
</div><a name="L166"></a><tt class="py-lineno">166</tt>  <tt class="py-line"> </tt>
<a name="Query.fetchblock"></a><div id="Query.fetchblock-def"><a name="L167"></a><tt class="py-lineno">167</tt> <a class="py-toggle" href="#" id="Query.fetchblock-toggle" onclick="return toggle('Query.fetchblock');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.Query-class.html#fetchblock">fetchblock</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">i</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="Query.fetchblock-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="Query.fetchblock-expanded"><a name="L168"></a><tt class="py-lineno">168</tt>  <tt class="py-line">        <tt class="py-name">di</tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-86" class="py-name" targets="Method p4vasp.db.Query.finddb()=p4vasp.db.Query-class.html#finddb"><a title="p4vasp.db.Query.finddb" class="py-name" href="#" onclick="return doclink('link-86', 'finddb', 'link-86');">finddb</a></tt><tt class="py-op">(</tt><tt id="link-87" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-87', 'i', 'link-73');">i</a></tt><tt class="py-op">)</tt> </tt>
<a name="L169"></a><tt class="py-lineno">169</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt class="py-name">di</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L170"></a><tt class="py-lineno">170</tt>  <tt class="py-line">            <tt class="py-name">d</tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">container</tt><tt class="py-op">[</tt><tt class="py-name">di</tt><tt class="py-op">]</tt> </tt>
<a name="L171"></a><tt class="py-lineno">171</tt>  <tt class="py-line">            <tt class="py-name">blocksize</tt><tt class="py-op">=</tt><tt class="py-name">d</tt><tt class="py-op">.</tt><tt class="py-name">blocksize</tt> </tt>
<a name="L172"></a><tt class="py-lineno">172</tt>  <tt class="py-line">            <tt class="py-name">offset</tt><tt class="py-op">=</tt><tt id="link-88" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-88', 'i', 'link-73');">i</a></tt><tt class="py-op">-</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cumulative</tt><tt class="py-op">[</tt><tt class="py-name">di</tt><tt class="py-op">]</tt> </tt>
<a name="L173"></a><tt class="py-lineno">173</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-89" class="py-name" targets="Method p4vasp.db.Query.shrinkCache()=p4vasp.db.Query-class.html#shrinkCache"><a title="p4vasp.db.Query.shrinkCache" class="py-name" href="#" onclick="return doclink('link-89', 'shrinkCache', 'link-89');">shrinkCache</a></tt><tt class="py-op">(</tt><tt id="link-90" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-90', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cache</tt><tt class="py-op">)</tt><tt class="py-op">+</tt><tt class="py-name">blocksize</tt><tt class="py-op">-</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cachesize</tt><tt class="py-op">)</tt> </tt>
<a name="L174"></a><tt class="py-lineno">174</tt>  <tt class="py-line">            <tt class="py-keyword">for</tt> <tt class="py-name">x</tt> <tt class="py-keyword">in</tt> <tt class="py-name">d</tt><tt class="py-op">.</tt><tt id="link-91" class="py-name" targets="Method p4vasp.db.DBI.fetchiter()=p4vasp.db.DBI-class.html#fetchiter,Method p4vasp.db.DBIContainer.fetchiter()=p4vasp.db.DBIContainer-class.html#fetchiter"><a title="p4vasp.db.DBI.fetchiter
p4vasp.db.DBIContainer.fetchiter" class="py-name" href="#" onclick="return doclink('link-91', 'fetchiter', 'link-91');">fetchiter</a></tt><tt class="py-op">(</tt><tt class="py-string">"SELECT %s %s %s LIMIT %d, %d"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-92" class="py-name"><a title="p4vasp.paint3d.data" class="py-name" href="#" onclick="return doclink('link-92', 'data', 'link-68');">data</a></tt><tt class="py-op">,</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">fromstatement</tt><tt class="py-op">,</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">condition</tt><tt class="py-op">,</tt><tt class="py-name">offset</tt><tt class="py-op">,</tt><tt class="py-name">blocksize</tt><tt class="py-op">)</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L175"></a><tt class="py-lineno">175</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-93" class="py-name" targets="Method p4vasp.db.Query.addToCache()=p4vasp.db.Query-class.html#addToCache"><a title="p4vasp.db.Query.addToCache" class="py-name" href="#" onclick="return doclink('link-93', 'addToCache', 'link-93');">addToCache</a></tt><tt class="py-op">(</tt><tt id="link-94" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-94', 'i', 'link-73');">i</a></tt><tt class="py-op">,</tt><tt class="py-op">(</tt><tt class="py-name">di</tt><tt class="py-op">,</tt><tt class="py-name">x</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L176"></a><tt class="py-lineno">176</tt>  <tt class="py-line">                <tt id="link-95" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-95', 'i', 'link-73');">i</a></tt><tt class="py-op">+=</tt><tt class="py-number">1</tt> </tt>
</div><a name="L177"></a><tt class="py-lineno">177</tt>  <tt class="py-line"> </tt>
<a name="Query.get"></a><div id="Query.get-def"><a name="L178"></a><tt class="py-lineno">178</tt> <a class="py-toggle" href="#" id="Query.get-toggle" onclick="return toggle('Query.get');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.Query-class.html#get">get</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">i</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="Query.get-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="Query.get-expanded"><a name="L179"></a><tt class="py-lineno">179</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt id="link-96" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-96', 'i', 'link-73');">i</a></tt><tt class="py-op">&gt;=</tt><tt class="py-number">0</tt> <tt class="py-keyword">and</tt> <tt id="link-97" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-97', 'i', 'link-73');">i</a></tt><tt class="py-op">&lt;</tt><tt id="link-98" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-98', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L180"></a><tt class="py-lineno">180</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">hash</tt><tt class="py-op">.</tt><tt id="link-99" class="py-name"><a title="p4vasp.Dictionary.StructuredDictionary.has_key" class="py-name" href="#" onclick="return doclink('link-99', 'has_key', 'link-17');">has_key</a></tt><tt class="py-op">(</tt><tt id="link-100" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-100', 'i', 'link-73');">i</a></tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L181"></a><tt class="py-lineno">181</tt>  <tt class="py-line"><tt class="py-comment">#        print "cache hit",i,self.hash[i],self.cache[self.hash[i]]</tt> </tt>
<a name="L182"></a><tt class="py-lineno">182</tt>  <tt class="py-line">                <tt class="py-keyword">return</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cache</tt><tt class="py-op">[</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">hash</tt><tt class="py-op">[</tt><tt id="link-101" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-101', 'i', 'link-73');">i</a></tt><tt class="py-op">]</tt><tt class="py-op">]</tt> </tt>
<a name="L183"></a><tt class="py-lineno">183</tt>  <tt class="py-line">            <tt class="py-keyword">else</tt><tt class="py-op">:</tt> </tt>
<a name="L184"></a><tt class="py-lineno">184</tt>  <tt class="py-line"><tt class="py-comment">#        print "not in cache -&gt; fetch",i</tt> </tt>
<a name="L185"></a><tt class="py-lineno">185</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-102" class="py-name" targets="Method p4vasp.db.Query.fetchblock()=p4vasp.db.Query-class.html#fetchblock"><a title="p4vasp.db.Query.fetchblock" class="py-name" href="#" onclick="return doclink('link-102', 'fetchblock', 'link-102');">fetchblock</a></tt><tt class="py-op">(</tt><tt id="link-103" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-103', 'i', 'link-73');">i</a></tt><tt class="py-op">)</tt> </tt>
<a name="L186"></a><tt class="py-lineno">186</tt>  <tt class="py-line">                <tt class="py-keyword">if</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">hash</tt><tt class="py-op">.</tt><tt id="link-104" class="py-name"><a title="p4vasp.Dictionary.StructuredDictionary.has_key" class="py-name" href="#" onclick="return doclink('link-104', 'has_key', 'link-17');">has_key</a></tt><tt class="py-op">(</tt><tt id="link-105" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-105', 'i', 'link-73');">i</a></tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L187"></a><tt class="py-lineno">187</tt>  <tt class="py-line"><tt class="py-comment">#          print "      got",i,self.hash[i],self.cache[self.hash[i]]</tt> </tt>
<a name="L188"></a><tt class="py-lineno">188</tt>  <tt class="py-line">                    <tt class="py-keyword">return</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cache</tt><tt class="py-op">[</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">hash</tt><tt class="py-op">[</tt><tt id="link-106" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-106', 'i', 'link-73');">i</a></tt><tt class="py-op">]</tt><tt class="py-op">]</tt> </tt>
<a name="L189"></a><tt class="py-lineno">189</tt>  <tt class="py-line">                <tt class="py-keyword">else</tt><tt class="py-op">:</tt> </tt>
<a name="L190"></a><tt class="py-lineno">190</tt>  <tt class="py-line"><tt class="py-comment">#          print "error -&gt; refresh"</tt> </tt>
<a name="L191"></a><tt class="py-lineno">191</tt>  <tt class="py-line">                    <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-107" class="py-name"><a title="p4vasp.db.Query.refresh" class="py-name" href="#" onclick="return doclink('link-107', 'refresh', 'link-70');">refresh</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L192"></a><tt class="py-lineno">192</tt>  <tt class="py-line">                    <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-108" class="py-name"><a title="p4vasp.db.Query.fetchblock" class="py-name" href="#" onclick="return doclink('link-108', 'fetchblock', 'link-102');">fetchblock</a></tt><tt class="py-op">(</tt><tt id="link-109" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-109', 'i', 'link-73');">i</a></tt><tt class="py-op">)</tt> </tt>
<a name="L193"></a><tt class="py-lineno">193</tt>  <tt class="py-line">                    <tt class="py-keyword">if</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">hash</tt><tt class="py-op">.</tt><tt id="link-110" class="py-name"><a title="p4vasp.Dictionary.StructuredDictionary.has_key" class="py-name" href="#" onclick="return doclink('link-110', 'has_key', 'link-17');">has_key</a></tt><tt class="py-op">(</tt><tt id="link-111" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-111', 'i', 'link-73');">i</a></tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L194"></a><tt class="py-lineno">194</tt>  <tt class="py-line"><tt class="py-comment">#            print "      got",i,self.hash[i],self.cache[self.hash[i]]</tt> </tt>
<a name="L195"></a><tt class="py-lineno">195</tt>  <tt class="py-line">                        <tt class="py-keyword">return</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cache</tt><tt class="py-op">[</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">hash</tt><tt class="py-op">[</tt><tt id="link-112" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-112', 'i', 'link-73');">i</a></tt><tt class="py-op">]</tt><tt class="py-op">]</tt> </tt>
<a name="L196"></a><tt class="py-lineno">196</tt>  <tt class="py-line">                    <tt class="py-keyword">else</tt><tt class="py-op">:</tt> </tt>
<a name="L197"></a><tt class="py-lineno">197</tt>  <tt class="py-line"><tt class="py-comment">#            print "FAILED"</tt> </tt>
<a name="L198"></a><tt class="py-lineno">198</tt>  <tt class="py-line">                        <tt class="py-keyword">return</tt> <tt class="py-name">None</tt> </tt>
</div><a name="L199"></a><tt class="py-lineno">199</tt>  <tt class="py-line"> </tt>
<a name="Query.getiter"></a><div id="Query.getiter-def"><a name="L200"></a><tt class="py-lineno">200</tt> <a class="py-toggle" href="#" id="Query.getiter-toggle" onclick="return toggle('Query.getiter');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.Query-class.html#getiter">getiter</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="Query.getiter-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="Query.getiter-expanded"><a name="L201"></a><tt class="py-lineno">201</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">container</tt><tt class="py-op">.</tt><tt id="link-113" class="py-name"><a title="p4vasp.db.DBI.fetchiter
p4vasp.db.DBIContainer.fetchiter" class="py-name" href="#" onclick="return doclink('link-113', 'fetchiter', 'link-91');">fetchiter</a></tt><tt class="py-op">(</tt><tt class="py-string">"SELECT %s %s"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-114" class="py-name"><a title="p4vasp.paint3d.data" class="py-name" href="#" onclick="return doclink('link-114', 'data', 'link-68');">data</a></tt><tt class="py-op">,</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">fromstatement</tt><tt class="py-op">,</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">condition</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
</div><a name="L202"></a><tt class="py-lineno">202</tt>  <tt class="py-line"> </tt>
<a name="Query.__getitem__"></a><div id="Query.__getitem__-def"><a name="L203"></a><tt class="py-lineno">203</tt> <a class="py-toggle" href="#" id="Query.__getitem__-toggle" onclick="return toggle('Query.__getitem__');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.Query-class.html#__getitem__">__getitem__</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">i</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="Query.__getitem__-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="Query.__getitem__-expanded"><a name="L204"></a><tt class="py-lineno">204</tt>  <tt class="py-line"><tt class="py-comment">#    print "getitem",i,"/",len(self),":",self.get(i)</tt> </tt>
<a name="L205"></a><tt class="py-lineno">205</tt>  <tt class="py-line">        <tt class="py-name">g</tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-115" class="py-name" targets="Method p4vasp.ODPdom.AttributeList.get()=p4vasp.ODPdom.AttributeList-class.html#get,Method p4vasp.ODPdom.NamedNodeMap.get()=p4vasp.ODPdom.NamedNodeMap-class.html#get,Method p4vasp.Property.Property.get()=p4vasp.Property.Property-class.html#get,Method p4vasp.cStructure.Structure.get()=p4vasp.cStructure.Structure-class.html#get,Method p4vasp.cmatrix.Matrix.get()=p4vasp.cmatrix.Matrix-class.html#get,Method p4vasp.cmatrix.Vector.get()=p4vasp.cmatrix.Vector-class.html#get,Method p4vasp.db.Query.get()=p4vasp.db.Query-class.html#get,Method p4vasp.matrix.Matrix.get()=p4vasp.matrix.Matrix-class.html#get,Method p4vasp.matrix.Vector.get()=p4vasp.matrix.Vector-class.html#get,Method p4vasp.paint3d.Paint3DInterface.Paint3DRecorder.get()=p4vasp.paint3d.Paint3DInterface.Paint3DRecorder-class.html#get"><a title="p4vasp.ODPdom.AttributeList.get
p4vasp.ODPdom.NamedNodeMap.get
p4vasp.Property.Property.get
p4vasp.cStructure.Structure.get
p4vasp.cmatrix.Matrix.get
p4vasp.cmatrix.Vector.get
p4vasp.db.Query.get
p4vasp.matrix.Matrix.get
p4vasp.matrix.Vector.get
p4vasp.paint3d.Paint3DInterface.Paint3DRecorder.get" class="py-name" href="#" onclick="return doclink('link-115', 'get', 'link-115');">get</a></tt><tt class="py-op">(</tt><tt id="link-116" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-116', 'i', 'link-73');">i</a></tt><tt class="py-op">)</tt> </tt>
<a name="L206"></a><tt class="py-lineno">206</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt class="py-name">g</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L207"></a><tt class="py-lineno">207</tt>  <tt class="py-line">            <tt class="py-keyword">return</tt> <tt class="py-name">g</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">]</tt> </tt>
</div><a name="L208"></a><tt class="py-lineno">208</tt>  <tt class="py-line"> </tt>
<a name="Query.__iter__"></a><div id="Query.__iter__-def"><a name="L209"></a><tt class="py-lineno">209</tt> <a class="py-toggle" href="#" id="Query.__iter__-toggle" onclick="return toggle('Query.__iter__');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.Query-class.html#__iter__">__iter__</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">i</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="Query.__iter__-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="Query.__iter__-expanded"><a name="L210"></a><tt class="py-lineno">210</tt>  <tt class="py-line">        <tt class="py-keyword">for</tt> <tt class="py-name">x</tt> <tt class="py-keyword">in</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-117" class="py-name" targets="Method p4vasp.db.Query.getiter()=p4vasp.db.Query-class.html#getiter"><a title="p4vasp.db.Query.getiter" class="py-name" href="#" onclick="return doclink('link-117', 'getiter', 'link-117');">getiter</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L211"></a><tt class="py-lineno">211</tt>  <tt class="py-line">            <tt class="py-keyword">yield</tt> <tt class="py-name">x</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">]</tt> </tt>
</div><a name="L212"></a><tt class="py-lineno">212</tt>  <tt class="py-line"> </tt>
<a name="Query.count"></a><div id="Query.count-def"><a name="L213"></a><tt class="py-lineno">213</tt> <a class="py-toggle" href="#" id="Query.count-toggle" onclick="return toggle('Query.count');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.Query-class.html#count">count</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="Query.count-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="Query.count-expanded"><a name="L214"></a><tt class="py-lineno">214</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">counts</tt>     <tt class="py-op">=</tt> <tt class="py-op">[</tt><tt class="py-op">]</tt> </tt>
<a name="L215"></a><tt class="py-lineno">215</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cumulative</tt> <tt class="py-op">=</tt> <tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt> </tt>
<a name="L216"></a><tt class="py-lineno">216</tt>  <tt class="py-line">        <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-number">0</tt> </tt>
<a name="L217"></a><tt class="py-lineno">217</tt>  <tt class="py-line"> </tt>
<a name="L218"></a><tt class="py-lineno">218</tt>  <tt class="py-line">        <tt class="py-keyword">for</tt> <tt class="py-name">d</tt> <tt class="py-keyword">in</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">container</tt><tt class="py-op">:</tt> </tt>
<a name="L219"></a><tt class="py-lineno">219</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">d</tt><tt class="py-op">.</tt><tt id="link-118" class="py-name" targets="Method p4vasp.db.DBI.isConnected()=p4vasp.db.DBI-class.html#isConnected,Method p4vasp.db.DBIContainer.isConnected()=p4vasp.db.DBIContainer-class.html#isConnected"><a title="p4vasp.db.DBI.isConnected
p4vasp.db.DBIContainer.isConnected" class="py-name" href="#" onclick="return doclink('link-118', 'isConnected', 'link-118');">isConnected</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L220"></a><tt class="py-lineno">220</tt>  <tt class="py-line">                <tt class="py-name">l</tt><tt class="py-op">=</tt><tt class="py-name">d</tt><tt class="py-op">.</tt><tt id="link-119" class="py-name"><a title="p4vasp.db.DBI.fetchvalue
p4vasp.db.DBIContainer.fetchvalue" class="py-name" href="#" onclick="return doclink('link-119', 'fetchvalue', 'link-65');">fetchvalue</a></tt><tt class="py-op">(</tt><tt class="py-string">"SELECT count(*) %s %s"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">fromstatement</tt><tt class="py-op">,</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">condition</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L221"></a><tt class="py-lineno">221</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">+=</tt><tt class="py-name">l</tt> </tt>
<a name="L222"></a><tt class="py-lineno">222</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">counts</tt><tt class="py-op">.</tt><tt id="link-120" class="py-name"><a title="p4vasp.Structure.AtomInfo.append
p4vasp.Structure.Structure.append
p4vasp.cStructure.AtomInfo.append
p4vasp.cStructure.Structure.append
p4vasp.graph.Graph.append
p4vasp.graph.World.append
p4vasp.repository.Repository.append" class="py-name" href="#" onclick="return doclink('link-120', 'append', 'link-84');">append</a></tt><tt class="py-op">(</tt><tt class="py-name">l</tt><tt class="py-op">)</tt> </tt>
<a name="L223"></a><tt class="py-lineno">223</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cumulative</tt><tt class="py-op">.</tt><tt id="link-121" class="py-name"><a title="p4vasp.Structure.AtomInfo.append
p4vasp.Structure.Structure.append
p4vasp.cStructure.AtomInfo.append
p4vasp.cStructure.Structure.append
p4vasp.graph.Graph.append
p4vasp.graph.World.append
p4vasp.repository.Repository.append" class="py-name" href="#" onclick="return doclink('link-121', 'append', 'link-84');">append</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt> </tt>
<a name="L224"></a><tt class="py-lineno">224</tt>  <tt class="py-line">            <tt class="py-keyword">else</tt><tt class="py-op">:</tt> </tt>
<a name="L225"></a><tt class="py-lineno">225</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">counts</tt><tt class="py-op">.</tt><tt id="link-122" class="py-name"><a title="p4vasp.Structure.AtomInfo.append
p4vasp.Structure.Structure.append
p4vasp.cStructure.AtomInfo.append
p4vasp.cStructure.Structure.append
p4vasp.graph.Graph.append
p4vasp.graph.World.append
p4vasp.repository.Repository.append" class="py-name" href="#" onclick="return doclink('link-122', 'append', 'link-84');">append</a></tt><tt class="py-op">(</tt><tt class="py-number">0</tt><tt class="py-op">)</tt> </tt>
<a name="L226"></a><tt class="py-lineno">226</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cumulative</tt><tt class="py-op">.</tt><tt id="link-123" class="py-name"><a title="p4vasp.Structure.AtomInfo.append
p4vasp.Structure.Structure.append
p4vasp.cStructure.AtomInfo.append
p4vasp.cStructure.Structure.append
p4vasp.graph.Graph.append
p4vasp.graph.World.append
p4vasp.repository.Repository.append" class="py-name" href="#" onclick="return doclink('link-123', 'append', 'link-84');">append</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt> </tt>
</div></div><a name="L227"></a><tt class="py-lineno">227</tt>  <tt class="py-line"> </tt>
<a name="L228"></a><tt class="py-lineno">228</tt>  <tt class="py-line"> </tt>
<a name="L229"></a><tt class="py-lineno">229</tt>  <tt class="py-line"> </tt>
<a name="DBIContainer"></a><div id="DBIContainer-def"><a name="L230"></a><tt class="py-lineno">230</tt> <a class="py-toggle" href="#" id="DBIContainer-toggle" onclick="return toggle('DBIContainer');">-</a><tt class="py-line"><tt class="py-keyword">class</tt> <a class="py-def-name" href="p4vasp.db.DBIContainer-class.html">DBIContainer</a><tt class="py-op">(</tt><tt class="py-base-class">UserList</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBIContainer-collapsed" style="display:none;" pad="+++" indent="++++"></div><div id="DBIContainer-expanded"><a name="DBIContainer.exe"></a><div id="DBIContainer.exe-def"><a name="L231"></a><tt class="py-lineno">231</tt> <a class="py-toggle" href="#" id="DBIContainer.exe-toggle" onclick="return toggle('DBIContainer.exe');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBIContainer-class.html#exe">exe</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">s</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBIContainer.exe-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBIContainer.exe-expanded"><a name="L232"></a><tt class="py-lineno">232</tt>  <tt class="py-line">        <tt class="py-keyword">for</tt> <tt class="py-name">x</tt> <tt class="py-keyword">in</tt> <tt class="py-name">self</tt><tt class="py-op">:</tt> </tt>
<a name="L233"></a><tt class="py-lineno">233</tt>  <tt class="py-line">            <tt class="py-name">x</tt><tt class="py-op">.</tt><tt id="link-124" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-124', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt> </tt>
</div><a name="L234"></a><tt class="py-lineno">234</tt>  <tt class="py-line"> </tt>
<a name="DBIContainer.fetchone"></a><div id="DBIContainer.fetchone-def"><a name="L235"></a><tt class="py-lineno">235</tt> <a class="py-toggle" href="#" id="DBIContainer.fetchone-toggle" onclick="return toggle('DBIContainer.fetchone');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBIContainer-class.html#fetchone">fetchone</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">s</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBIContainer.fetchone-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBIContainer.fetchone-expanded"><a name="L236"></a><tt class="py-lineno">236</tt>  <tt class="py-line">        <tt class="py-keyword">for</tt> <tt class="py-name">x</tt> <tt class="py-keyword">in</tt> <tt class="py-name">self</tt><tt class="py-op">:</tt> </tt>
<a name="L237"></a><tt class="py-lineno">237</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">x</tt><tt class="py-op">.</tt><tt id="link-125" class="py-name"><a title="p4vasp.db.DBI.isConnected
p4vasp.db.DBIContainer.isConnected" class="py-name" href="#" onclick="return doclink('link-125', 'isConnected', 'link-118');">isConnected</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L238"></a><tt class="py-lineno">238</tt>  <tt class="py-line">                <tt class="py-name">v</tt><tt class="py-op">=</tt><tt class="py-name">x</tt><tt class="py-op">.</tt><tt id="link-126" class="py-name"><a title="p4vasp.db.DBI.fetchone
p4vasp.db.DBIContainer.fetchone" class="py-name" href="#" onclick="return doclink('link-126', 'fetchone', 'link-49');">fetchone</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt> </tt>
<a name="L239"></a><tt class="py-lineno">239</tt>  <tt class="py-line">                <tt class="py-keyword">if</tt> <tt class="py-name">v</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L240"></a><tt class="py-lineno">240</tt>  <tt class="py-line">                    <tt class="py-keyword">return</tt> <tt class="py-name">v</tt> </tt>
<a name="L241"></a><tt class="py-lineno">241</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-name">None</tt> </tt>
</div><a name="L242"></a><tt class="py-lineno">242</tt>  <tt class="py-line"> </tt>
<a name="DBIContainer.fetchiter"></a><div id="DBIContainer.fetchiter-def"><a name="L243"></a><tt class="py-lineno">243</tt> <a class="py-toggle" href="#" id="DBIContainer.fetchiter-toggle" onclick="return toggle('DBIContainer.fetchiter');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBIContainer-class.html#fetchiter">fetchiter</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">s</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBIContainer.fetchiter-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBIContainer.fetchiter-expanded"><a name="L244"></a><tt class="py-lineno">244</tt>  <tt class="py-line">        <tt class="py-keyword">for</tt> <tt class="py-name">d</tt> <tt class="py-keyword">in</tt> <tt class="py-name">self</tt><tt class="py-op">:</tt> </tt>
<a name="L245"></a><tt class="py-lineno">245</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">d</tt><tt class="py-op">.</tt><tt id="link-127" class="py-name"><a title="p4vasp.db.DBI.isConnected
p4vasp.db.DBIContainer.isConnected" class="py-name" href="#" onclick="return doclink('link-127', 'isConnected', 'link-118');">isConnected</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L246"></a><tt class="py-lineno">246</tt>  <tt class="py-line">                <tt class="py-keyword">for</tt> <tt class="py-name">r</tt> <tt class="py-keyword">in</tt> <tt class="py-name">d</tt><tt class="py-op">.</tt><tt id="link-128" class="py-name"><a title="p4vasp.db.DBI.fetchiter
p4vasp.db.DBIContainer.fetchiter" class="py-name" href="#" onclick="return doclink('link-128', 'fetchiter', 'link-91');">fetchiter</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L247"></a><tt class="py-lineno">247</tt>  <tt class="py-line">                    <tt class="py-keyword">yield</tt> <tt class="py-name">r</tt> </tt>
</div><a name="L248"></a><tt class="py-lineno">248</tt>  <tt class="py-line"> </tt>
<a name="DBIContainer.query"></a><div id="DBIContainer.query-def"><a name="L249"></a><tt class="py-lineno">249</tt> <a class="py-toggle" href="#" id="DBIContainer.query-toggle" onclick="return toggle('DBIContainer.query');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBIContainer-class.html#query">query</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt> <tt class="py-param">data</tt><tt class="py-op">,</tt> <tt class="py-param">fromstatement</tt><tt class="py-op">,</tt><tt class="py-param">condition</tt><tt class="py-op">=</tt><tt class="py-string">""</tt><tt class="py-op">,</tt><tt class="py-param">cachesize</tt><tt class="py-op">=</tt><tt class="py-number">200</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBIContainer.query-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBIContainer.query-expanded"><a name="L250"></a><tt class="py-lineno">250</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt id="link-129" class="py-name" targets="Class p4vasp.db.Query=p4vasp.db.Query-class.html"><a title="p4vasp.db.Query" class="py-name" href="#" onclick="return doclink('link-129', 'Query', 'link-129');">Query</a></tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">,</tt><tt id="link-130" class="py-name"><a title="p4vasp.paint3d.data" class="py-name" href="#" onclick="return doclink('link-130', 'data', 'link-68');">data</a></tt><tt class="py-op">,</tt><tt class="py-name">fromstatement</tt><tt class="py-op">,</tt><tt class="py-name">condition</tt><tt class="py-op">,</tt><tt class="py-name">cachesize</tt><tt class="py-op">)</tt> </tt>
</div><a name="L251"></a><tt class="py-lineno">251</tt>  <tt class="py-line"> </tt>
<a name="DBIContainer.fetchvalue"></a><div id="DBIContainer.fetchvalue-def"><a name="L252"></a><tt class="py-lineno">252</tt> <a class="py-toggle" href="#" id="DBIContainer.fetchvalue-toggle" onclick="return toggle('DBIContainer.fetchvalue');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBIContainer-class.html#fetchvalue">fetchvalue</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">s</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBIContainer.fetchvalue-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBIContainer.fetchvalue-expanded"><a name="L253"></a><tt class="py-lineno">253</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-131" class="py-name"><a title="p4vasp.db.DBI.fetchone
p4vasp.db.DBIContainer.fetchone" class="py-name" href="#" onclick="return doclink('link-131', 'fetchone', 'link-49');">fetchone</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt> </tt>
</div><a name="L254"></a><tt class="py-lineno">254</tt>  <tt class="py-line"> </tt>
<a name="DBIContainer.run"></a><div id="DBIContainer.run-def"><a name="L255"></a><tt class="py-lineno">255</tt> <a class="py-toggle" href="#" id="DBIContainer.run-toggle" onclick="return toggle('DBIContainer.run');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBIContainer-class.html#run">run</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">s</tt><tt class="py-op">,</tt><tt class="py-param">ignore_errors</tt><tt class="py-op">=</tt><tt class="py-number">0</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBIContainer.run-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBIContainer.run-expanded"><a name="L256"></a><tt class="py-lineno">256</tt>  <tt class="py-line">        <tt class="py-keyword">for</tt> <tt class="py-name">x</tt> <tt class="py-keyword">in</tt> <tt class="py-name">self</tt><tt class="py-op">:</tt> </tt>
<a name="L257"></a><tt class="py-lineno">257</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">x</tt><tt class="py-op">.</tt><tt id="link-132" class="py-name"><a title="p4vasp.db.DBI.isConnected
p4vasp.db.DBIContainer.isConnected" class="py-name" href="#" onclick="return doclink('link-132', 'isConnected', 'link-118');">isConnected</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L258"></a><tt class="py-lineno">258</tt>  <tt class="py-line">                <tt class="py-name">x</tt><tt class="py-op">.</tt><tt id="link-133" class="py-name"><a title="p4vasp.db.DBI.run
p4vasp.db.DBIContainer.run
p4vasp.schedule'.Scheduler.run" class="py-name" href="#" onclick="return doclink('link-133', 'run', 'link-61');">run</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">,</tt><tt class="py-name">ignore_errors</tt><tt class="py-op">=</tt><tt class="py-name">ignore_errors</tt><tt class="py-op">)</tt> </tt>
</div><a name="L259"></a><tt class="py-lineno">259</tt>  <tt class="py-line"> </tt>
<a name="DBIContainer.commit"></a><div id="DBIContainer.commit-def"><a name="L260"></a><tt class="py-lineno">260</tt> <a class="py-toggle" href="#" id="DBIContainer.commit-toggle" onclick="return toggle('DBIContainer.commit');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBIContainer-class.html#commit">commit</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBIContainer.commit-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBIContainer.commit-expanded"><a name="L261"></a><tt class="py-lineno">261</tt>  <tt class="py-line">        <tt class="py-keyword">for</tt> <tt class="py-name">x</tt> <tt class="py-keyword">in</tt> <tt class="py-name">self</tt><tt class="py-op">:</tt> </tt>
<a name="L262"></a><tt class="py-lineno">262</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">x</tt><tt class="py-op">.</tt><tt id="link-134" class="py-name"><a title="p4vasp.db.DBI.isConnected
p4vasp.db.DBIContainer.isConnected" class="py-name" href="#" onclick="return doclink('link-134', 'isConnected', 'link-118');">isConnected</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L263"></a><tt class="py-lineno">263</tt>  <tt class="py-line">                <tt class="py-name">x</tt><tt class="py-op">.</tt><tt id="link-135" class="py-name"><a title="p4vasp.db.DBI.commit
p4vasp.db.DBIContainer.commit
p4vasp.db.MySQLDBI.commit" class="py-name" href="#" onclick="return doclink('link-135', 'commit', 'link-67');">commit</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
</div><a name="L264"></a><tt class="py-lineno">264</tt>  <tt class="py-line"> </tt>
<a name="DBIContainer.connect"></a><div id="DBIContainer.connect-def"><a name="L265"></a><tt class="py-lineno">265</tt> <a class="py-toggle" href="#" id="DBIContainer.connect-toggle" onclick="return toggle('DBIContainer.connect');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBIContainer-class.html#connect">connect</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBIContainer.connect-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBIContainer.connect-expanded"><a name="L266"></a><tt class="py-lineno">266</tt>  <tt class="py-line">        <tt class="py-keyword">for</tt> <tt class="py-name">x</tt> <tt class="py-keyword">in</tt> <tt class="py-name">self</tt><tt class="py-op">:</tt> </tt>
<a name="L267"></a><tt class="py-lineno">267</tt>  <tt class="py-line">            <tt class="py-keyword">try</tt><tt class="py-op">:</tt> </tt>
<a name="L268"></a><tt class="py-lineno">268</tt>  <tt class="py-line">                <tt class="py-name">x</tt><tt class="py-op">.</tt><tt id="link-136" class="py-name"><a title="p4vasp.db.DBI.connect
p4vasp.db.DBIContainer.connect
p4vasp.db.MySQLDBI.connect
p4vasp.db.SQLiteDBI.connect" class="py-name" href="#" onclick="return doclink('link-136', 'connect', 'link-14');">connect</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L269"></a><tt class="py-lineno">269</tt>  <tt class="py-line">            <tt class="py-keyword">except</tt><tt class="py-op">:</tt> </tt>
<a name="L270"></a><tt class="py-lineno">270</tt>  <tt class="py-line">                <tt id="link-137" class="py-name" targets="Function p4vasp.msg()=p4vasp-module.html#msg"><a title="p4vasp.msg" class="py-name" href="#" onclick="return doclink('link-137', 'msg', 'link-137');">msg</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">.</tt><tt id="link-138" class="py-name" targets="Method p4vasp.message.MessageDriver.exception()=p4vasp.message.MessageDriver-class.html#exception"><a title="p4vasp.message.MessageDriver.exception" class="py-name" href="#" onclick="return doclink('link-138', 'exception', 'link-138');">exception</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
</div><a name="L271"></a><tt class="py-lineno">271</tt>  <tt class="py-line"> </tt>
<a name="DBIContainer.disconnect"></a><div id="DBIContainer.disconnect-def"><a name="L272"></a><tt class="py-lineno">272</tt> <a class="py-toggle" href="#" id="DBIContainer.disconnect-toggle" onclick="return toggle('DBIContainer.disconnect');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBIContainer-class.html#disconnect">disconnect</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBIContainer.disconnect-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBIContainer.disconnect-expanded"><a name="L273"></a><tt class="py-lineno">273</tt>  <tt class="py-line">        <tt class="py-keyword">for</tt> <tt class="py-name">x</tt> <tt class="py-keyword">in</tt> <tt class="py-name">self</tt><tt class="py-op">:</tt> </tt>
<a name="L274"></a><tt class="py-lineno">274</tt>  <tt class="py-line">            <tt class="py-name">x</tt><tt class="py-op">.</tt><tt id="link-139" class="py-name" targets="Method p4vasp.db.DBI.disconnect()=p4vasp.db.DBI-class.html#disconnect,Method p4vasp.db.DBIContainer.disconnect()=p4vasp.db.DBIContainer-class.html#disconnect,Method p4vasp.db.MySQLDBI.disconnect()=p4vasp.db.MySQLDBI-class.html#disconnect,Method p4vasp.db.SQLiteDBI.disconnect()=p4vasp.db.SQLiteDBI-class.html#disconnect"><a title="p4vasp.db.DBI.disconnect
p4vasp.db.DBIContainer.disconnect
p4vasp.db.MySQLDBI.disconnect
p4vasp.db.SQLiteDBI.disconnect" class="py-name" href="#" onclick="return doclink('link-139', 'disconnect', 'link-139');">disconnect</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
</div><a name="L275"></a><tt class="py-lineno">275</tt>  <tt class="py-line"> </tt>
<a name="DBIContainer.isConnected"></a><div id="DBIContainer.isConnected-def"><a name="L276"></a><tt class="py-lineno">276</tt> <a class="py-toggle" href="#" id="DBIContainer.isConnected-toggle" onclick="return toggle('DBIContainer.isConnected');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.DBIContainer-class.html#isConnected">isConnected</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="DBIContainer.isConnected-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="DBIContainer.isConnected-expanded"><a name="L277"></a><tt class="py-lineno">277</tt>  <tt class="py-line">        <tt class="py-keyword">for</tt> <tt class="py-name">x</tt> <tt class="py-keyword">in</tt> <tt class="py-name">self</tt><tt class="py-op">:</tt> </tt>
<a name="L278"></a><tt class="py-lineno">278</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">x</tt><tt class="py-op">.</tt><tt id="link-140" class="py-name"><a title="p4vasp.db.DBI.isConnected
p4vasp.db.DBIContainer.isConnected" class="py-name" href="#" onclick="return doclink('link-140', 'isConnected', 'link-118');">isConnected</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L279"></a><tt class="py-lineno">279</tt>  <tt class="py-line">                <tt class="py-keyword">return</tt> <tt class="py-number">1</tt> </tt>
<a name="L280"></a><tt class="py-lineno">280</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-number">0</tt> </tt>
</div></div><a name="L281"></a><tt class="py-lineno">281</tt>  <tt class="py-line"> </tt>
<a name="L282"></a><tt class="py-lineno">282</tt>  <tt class="py-line"> </tt>
<a name="L283"></a><tt class="py-lineno">283</tt>  <tt class="py-line"> </tt>
<a name="von"></a><div id="von-def"><a name="L284"></a><tt class="py-lineno">284</tt> <a class="py-toggle" href="#" id="von-toggle" onclick="return toggle('von');">-</a><tt class="py-line"><tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db-module.html#von">von</a><tt class="py-op">(</tt><tt class="py-param">x</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="von-collapsed" style="display:none;" pad="+++" indent="++++"></div><div id="von-expanded"><a name="L285"></a><tt class="py-lineno">285</tt>  <tt class="py-line">    <tt class="py-docstring">"str(x) or NULL"</tt> </tt>
<a name="L286"></a><tt class="py-lineno">286</tt>  <tt class="py-line">    <tt class="py-keyword">if</tt> <tt class="py-name">x</tt> <tt class="py-keyword">is</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L287"></a><tt class="py-lineno">287</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-string">"NULL"</tt> </tt>
<a name="L288"></a><tt class="py-lineno">288</tt>  <tt class="py-line">    <tt class="py-keyword">else</tt><tt class="py-op">:</tt> </tt>
<a name="L289"></a><tt class="py-lineno">289</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-name">str</tt><tt class="py-op">(</tt><tt class="py-name">x</tt><tt class="py-op">)</tt> </tt>
</div><a name="L290"></a><tt class="py-lineno">290</tt>  <tt class="py-line"> </tt>
<a name="son"></a><div id="son-def"><a name="L291"></a><tt class="py-lineno">291</tt> <a class="py-toggle" href="#" id="son-toggle" onclick="return toggle('son');">-</a><tt class="py-line"><tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db-module.html#son">son</a><tt class="py-op">(</tt><tt class="py-param">x</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="son-collapsed" style="display:none;" pad="+++" indent="++++"></div><div id="son-expanded"><a name="L292"></a><tt class="py-lineno">292</tt>  <tt class="py-line">    <tt class="py-docstring">'"str(x)" or NULL'</tt> </tt>
<a name="L293"></a><tt class="py-lineno">293</tt>  <tt class="py-line">    <tt class="py-keyword">if</tt> <tt class="py-name">x</tt> <tt class="py-keyword">is</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L294"></a><tt class="py-lineno">294</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-string">"NULL"</tt> </tt>
<a name="L295"></a><tt class="py-lineno">295</tt>  <tt class="py-line">    <tt class="py-keyword">else</tt><tt class="py-op">:</tt> </tt>
<a name="L296"></a><tt class="py-lineno">296</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-string">'"%s"'</tt><tt class="py-op">%</tt><tt class="py-name">str</tt><tt class="py-op">(</tt><tt class="py-name">x</tt><tt class="py-op">)</tt> </tt>
</div><a name="L297"></a><tt class="py-lineno">297</tt>  <tt class="py-line"> </tt>
<a name="UserManagementMixin"></a><div id="UserManagementMixin-def"><a name="L298"></a><tt class="py-lineno">298</tt> <a class="py-toggle" href="#" id="UserManagementMixin-toggle" onclick="return toggle('UserManagementMixin');">-</a><tt class="py-line"><tt class="py-keyword">class</tt> <a class="py-def-name" href="p4vasp.db.UserManagementMixin-class.html">UserManagementMixin</a><tt class="py-op">(</tt><tt class="py-base-class">DBI</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="UserManagementMixin-collapsed" style="display:none;" pad="+++" indent="++++"></div><div id="UserManagementMixin-expanded"><a name="UserManagementMixin.init"></a><div id="UserManagementMixin.init-def"><a name="L299"></a><tt class="py-lineno">299</tt> <a class="py-toggle" href="#" id="UserManagementMixin.init-toggle" onclick="return toggle('UserManagementMixin.init');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.UserManagementMixin-class.html#init">init</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="UserManagementMixin.init-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="UserManagementMixin.init-expanded"><a name="L300"></a><tt class="py-lineno">300</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">user_id</tt><tt class="py-op">=</tt><tt class="py-name">None</tt> </tt>
</div><a name="L301"></a><tt class="py-lineno">301</tt>  <tt class="py-line"> </tt>
<a name="UserManagementMixin.getUserName"></a><div id="UserManagementMixin.getUserName-def"><a name="L302"></a><tt class="py-lineno">302</tt> <a class="py-toggle" href="#" id="UserManagementMixin.getUserName-toggle" onclick="return toggle('UserManagementMixin.getUserName');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.UserManagementMixin-class.html#getUserName">getUserName</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="UserManagementMixin.getUserName-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="UserManagementMixin.getUserName-expanded"><a name="L303"></a><tt class="py-lineno">303</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cfg</tt><tt class="py-op">[</tt><tt class="py-string">"username"</tt><tt class="py-op">]</tt> </tt>
</div><a name="L304"></a><tt class="py-lineno">304</tt>  <tt class="py-line"> </tt>
<a name="UserManagementMixin.getUserUID"></a><div id="UserManagementMixin.getUserUID-def"><a name="L305"></a><tt class="py-lineno">305</tt> <a class="py-toggle" href="#" id="UserManagementMixin.getUserUID-toggle" onclick="return toggle('UserManagementMixin.getUserUID');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.UserManagementMixin-class.html#getUserUID">getUserUID</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="UserManagementMixin.getUserUID-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="UserManagementMixin.getUserUID-expanded"><a name="L306"></a><tt class="py-lineno">306</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cfg</tt><tt class="py-op">[</tt><tt class="py-string">"user_uid"</tt><tt class="py-op">]</tt> </tt>
</div><a name="L307"></a><tt class="py-lineno">307</tt>  <tt class="py-line"> </tt>
<a name="UserManagementMixin.login"></a><div id="UserManagementMixin.login-def"><a name="L308"></a><tt class="py-lineno">308</tt> <a class="py-toggle" href="#" id="UserManagementMixin.login-toggle" onclick="return toggle('UserManagementMixin.login');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.UserManagementMixin-class.html#login">login</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="UserManagementMixin.login-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="UserManagementMixin.login-expanded"><a name="L309"></a><tt class="py-lineno">309</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-141" class="py-name" targets="Method p4vasp.db.DBI.assure()=p4vasp.db.DBI-class.html#assure"><a title="p4vasp.db.DBI.assure" class="py-name" href="#" onclick="return doclink('link-141', 'assure', 'link-141');">assure</a></tt><tt class="py-op">(</tt><tt class="py-string">"#USER_UID"</tt><tt class="py-op">)</tt> </tt>
<a name="L310"></a><tt class="py-lineno">310</tt>  <tt class="py-line">        <tt class="py-keyword">try</tt><tt class="py-op">:</tt> </tt>
<a name="L311"></a><tt class="py-lineno">311</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">user_id</tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-142" class="py-name"><a title="p4vasp.db.DBI.fetchvalue
p4vasp.db.DBIContainer.fetchvalue" class="py-name" href="#" onclick="return doclink('link-142', 'fetchvalue', 'link-65');">fetchvalue</a></tt><tt class="py-op">(</tt><tt class="py-string">'SELECT id FROM #USERINFO WHERE user_uid=#USER_UID'</tt><tt class="py-op">)</tt> </tt>
<a name="L312"></a><tt class="py-lineno">312</tt>  <tt class="py-line">        <tt class="py-keyword">except</tt><tt class="py-op">:</tt> </tt>
<a name="L313"></a><tt class="py-lineno">313</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">user_id</tt><tt class="py-op">=</tt><tt class="py-name">None</tt> </tt>
<a name="L314"></a><tt class="py-lineno">314</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">user_id</tt> </tt>
</div><a name="L315"></a><tt class="py-lineno">315</tt>  <tt class="py-line"> </tt>
<a name="L316"></a><tt class="py-lineno">316</tt>  <tt class="py-line"> </tt>
<a name="UserManagementMixin.addUser"></a><div id="UserManagementMixin.addUser-def"><a name="L317"></a><tt class="py-lineno">317</tt> <a class="py-toggle" href="#" id="UserManagementMixin.addUser-toggle" onclick="return toggle('UserManagementMixin.addUser');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.UserManagementMixin-class.html#addUser">addUser</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="UserManagementMixin.addUser-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="UserManagementMixin.addUser-expanded"><a name="L318"></a><tt class="py-lineno">318</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-143" class="py-name"><a title="p4vasp.db.DBI.assure" class="py-name" href="#" onclick="return doclink('link-143', 'assure', 'link-141');">assure</a></tt><tt class="py-op">(</tt><tt class="py-string">"#USER_UID"</tt><tt class="py-op">)</tt> </tt>
<a name="L319"></a><tt class="py-lineno">319</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-144" class="py-name"><a title="p4vasp.db.DBI.assure" class="py-name" href="#" onclick="return doclink('link-144', 'assure', 'link-141');">assure</a></tt><tt class="py-op">(</tt><tt class="py-string">"#USERNAME"</tt><tt class="py-op">)</tt> </tt>
<a name="L320"></a><tt class="py-lineno">320</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-145" class="py-name" targets="Method p4vasp.db.UserManagementMixin.getUserID()=p4vasp.db.UserManagementMixin-class.html#getUserID"><a title="p4vasp.db.UserManagementMixin.getUserID" class="py-name" href="#" onclick="return doclink('link-145', 'getUserID', 'link-145');">getUserID</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> <tt class="py-keyword">is</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L321"></a><tt class="py-lineno">321</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-146" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-146', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">"INSERT INTO #USERINFO (user_uid,username) VALUES (#USER_UID, #USERNAME)"</tt><tt class="py-op">)</tt> </tt>
<a name="L322"></a><tt class="py-lineno">322</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-147" class="py-name"><a title="p4vasp.db.DBI.commit
p4vasp.db.DBIContainer.commit
p4vasp.db.MySQLDBI.commit" class="py-name" href="#" onclick="return doclink('link-147', 'commit', 'link-67');">commit</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L323"></a><tt class="py-lineno">323</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-148" class="py-name" targets="Method p4vasp.db.UserManagementMixin.login()=p4vasp.db.UserManagementMixin-class.html#login"><a title="p4vasp.db.UserManagementMixin.login" class="py-name" href="#" onclick="return doclink('link-148', 'login', 'link-148');">login</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
</div><a name="L324"></a><tt class="py-lineno">324</tt>  <tt class="py-line"> </tt>
<a name="UserManagementMixin.getUserID"></a><div id="UserManagementMixin.getUserID-def"><a name="L325"></a><tt class="py-lineno">325</tt> <a class="py-toggle" href="#" id="UserManagementMixin.getUserID-toggle" onclick="return toggle('UserManagementMixin.getUserID');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.UserManagementMixin-class.html#getUserID">getUserID</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="UserManagementMixin.getUserID-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="UserManagementMixin.getUserID-expanded"><a name="L326"></a><tt class="py-lineno">326</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">user_id</tt> <tt class="py-keyword">is</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L327"></a><tt class="py-lineno">327</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-149" class="py-name"><a title="p4vasp.db.UserManagementMixin.login" class="py-name" href="#" onclick="return doclink('link-149', 'login', 'link-148');">login</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L328"></a><tt class="py-lineno">328</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">user_id</tt> </tt>
</div><a name="L329"></a><tt class="py-lineno">329</tt>  <tt class="py-line"> </tt>
<a name="UserManagementMixin.onConnect"></a><div id="UserManagementMixin.onConnect-def"><a name="L330"></a><tt class="py-lineno">330</tt> <a class="py-toggle" href="#" id="UserManagementMixin.onConnect-toggle" onclick="return toggle('UserManagementMixin.onConnect');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.UserManagementMixin-class.html#onConnect">onConnect</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="UserManagementMixin.onConnect-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="UserManagementMixin.onConnect-expanded"><a name="L331"></a><tt class="py-lineno">331</tt>  <tt class="py-line">        <tt class="py-keyword">try</tt><tt class="py-op">:</tt> </tt>
<a name="L332"></a><tt class="py-lineno">332</tt>  <tt class="py-line">            <tt class="py-name">scriptname</tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cfg</tt><tt class="py-op">[</tt><tt class="py-string">"creation_script"</tt><tt class="py-op">]</tt> </tt>
<a name="L333"></a><tt class="py-lineno">333</tt>  <tt class="py-line">        <tt class="py-keyword">except</tt><tt class="py-op">:</tt> </tt>
<a name="L334"></a><tt class="py-lineno">334</tt>  <tt class="py-line">            <tt class="py-keyword">return</tt> </tt>
<a name="L335"></a><tt class="py-lineno">335</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-150" class="py-name" targets="Method p4vasp.db.DBI.runfile()=p4vasp.db.DBI-class.html#runfile"><a title="p4vasp.db.DBI.runfile" class="py-name" href="#" onclick="return doclink('link-150', 'runfile', 'link-150');">runfile</a></tt><tt class="py-op">(</tt><tt class="py-name">scriptname</tt><tt class="py-op">,</tt><tt class="py-name">ignore_errors</tt><tt class="py-op">=</tt><tt class="py-number">1</tt><tt class="py-op">)</tt> </tt>
</div></div><a name="L336"></a><tt class="py-lineno">336</tt>  <tt class="py-line"> </tt>
<a name="L337"></a><tt class="py-lineno">337</tt>  <tt class="py-line"> </tt>
<a name="P4VMixin"></a><div id="P4VMixin-def"><a name="L338"></a><tt class="py-lineno">338</tt> <a class="py-toggle" href="#" id="P4VMixin-toggle" onclick="return toggle('P4VMixin');">-</a><tt class="py-line"><tt class="py-keyword">class</tt> <a class="py-def-name" href="p4vasp.db.P4VMixin-class.html">P4VMixin</a><tt class="py-op">(</tt><tt class="py-base-class">UserManagementMixin</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="P4VMixin-collapsed" style="display:none;" pad="+++" indent="++++"></div><div id="P4VMixin-expanded"><a name="P4VMixin.init"></a><div id="P4VMixin.init-def"><a name="L339"></a><tt class="py-lineno">339</tt> <a class="py-toggle" href="#" id="P4VMixin.init-toggle" onclick="return toggle('P4VMixin.init');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.P4VMixin-class.html#init">init</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">calc_id</tt><tt class="py-op">=</tt><tt class="py-name">None</tt><tt class="py-op">,</tt><tt class="py-param">pm</tt><tt class="py-op">=</tt><tt class="py-name">None</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="P4VMixin.init-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="P4VMixin.init-expanded"><a name="L340"></a><tt class="py-lineno">340</tt>  <tt class="py-line">        <tt id="link-151" class="py-name" targets="Class p4vasp.db.UserManagementMixin=p4vasp.db.UserManagementMixin-class.html"><a title="p4vasp.db.UserManagementMixin" class="py-name" href="#" onclick="return doclink('link-151', 'UserManagementMixin', 'link-151');">UserManagementMixin</a></tt><tt class="py-op">.</tt><tt id="link-152" class="py-name"><a title="p4vasp.db.P4VMixin.init
p4vasp.db.UserManagementMixin.init" class="py-name" href="#" onclick="return doclink('link-152', 'init', 'link-16');">init</a></tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">)</tt> </tt>
<a name="L341"></a><tt class="py-lineno">341</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">calc_id</tt><tt class="py-op">=</tt><tt class="py-name">calc_id</tt> </tt>
<a name="L342"></a><tt class="py-lineno">342</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">pm</tt><tt class="py-op">=</tt><tt class="py-name">pm</tt> </tt>
</div><a name="L343"></a><tt class="py-lineno">343</tt>  <tt class="py-line"> </tt>
<a name="L344"></a><tt class="py-lineno">344</tt>  <tt class="py-line"> </tt>
<a name="P4VMixin.getDefaultCommit"></a><div id="P4VMixin.getDefaultCommit-def"><a name="L345"></a><tt class="py-lineno">345</tt> <a class="py-toggle" href="#" id="P4VMixin.getDefaultCommit-toggle" onclick="return toggle('P4VMixin.getDefaultCommit');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.P4VMixin-class.html#getDefaultCommit">getDefaultCommit</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="P4VMixin.getDefaultCommit-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="P4VMixin.getDefaultCommit-expanded"><a name="L346"></a><tt class="py-lineno">346</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cfg</tt><tt class="py-op">.</tt><tt id="link-153" class="py-name"><a title="p4vasp.Dictionary.StructuredDictionary.has_key" class="py-name" href="#" onclick="return doclink('link-153', 'has_key', 'link-17');">has_key</a></tt><tt class="py-op">(</tt><tt class="py-string">"default_commit"</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L347"></a><tt class="py-lineno">347</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">lower</tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cfg</tt><tt class="py-op">[</tt><tt class="py-string">"default_commit"</tt><tt class="py-op">]</tt><tt class="py-op">)</tt> <tt class="py-keyword">in</tt> <tt class="py-op">[</tt><tt class="py-string">"t"</tt><tt class="py-op">,</tt><tt class="py-string">"true"</tt><tt class="py-op">,</tt><tt class="py-string">"yes"</tt><tt class="py-op">,</tt><tt class="py-string">"y"</tt><tt class="py-op">,</tt><tt class="py-string">"enable"</tt><tt class="py-op">,</tt><tt class="py-string">"enabled"</tt><tt class="py-op">]</tt><tt class="py-op">:</tt> </tt>
<a name="L348"></a><tt class="py-lineno">348</tt>  <tt class="py-line">                <tt class="py-keyword">return</tt> <tt class="py-number">1</tt> </tt>
<a name="L349"></a><tt class="py-lineno">349</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-number">0</tt> </tt>
</div><a name="L350"></a><tt class="py-lineno">350</tt>  <tt class="py-line"> </tt>
<a name="P4VMixin.canCommit"></a><div id="P4VMixin.canCommit-def"><a name="L351"></a><tt class="py-lineno">351</tt> <a class="py-toggle" href="#" id="P4VMixin.canCommit-toggle" onclick="return toggle('P4VMixin.canCommit');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.P4VMixin-class.html#canCommit">canCommit</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="P4VMixin.canCommit-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="P4VMixin.canCommit-expanded"><a name="L352"></a><tt class="py-lineno">352</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cfg</tt><tt class="py-op">.</tt><tt id="link-154" class="py-name"><a title="p4vasp.Dictionary.StructuredDictionary.has_key" class="py-name" href="#" onclick="return doclink('link-154', 'has_key', 'link-17');">has_key</a></tt><tt class="py-op">(</tt><tt class="py-string">"commit"</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L353"></a><tt class="py-lineno">353</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">lower</tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">cfg</tt><tt class="py-op">[</tt><tt class="py-string">"commit"</tt><tt class="py-op">]</tt><tt class="py-op">)</tt> <tt class="py-keyword">in</tt> <tt class="py-op">[</tt><tt class="py-string">"t"</tt><tt class="py-op">,</tt><tt class="py-string">"true"</tt><tt class="py-op">,</tt><tt class="py-string">"yes"</tt><tt class="py-op">,</tt><tt class="py-string">"y"</tt><tt class="py-op">,</tt><tt class="py-string">"enable"</tt><tt class="py-op">,</tt><tt class="py-string">"enabled"</tt><tt class="py-op">]</tt><tt class="py-op">:</tt> </tt>
<a name="L354"></a><tt class="py-lineno">354</tt>  <tt class="py-line">                <tt class="py-keyword">return</tt> <tt class="py-number">1</tt> </tt>
<a name="L355"></a><tt class="py-lineno">355</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-number">0</tt> </tt>
</div><a name="L356"></a><tt class="py-lineno">356</tt>  <tt class="py-line"> </tt>
<a name="P4VMixin.addRecord"></a><div id="P4VMixin.addRecord-def"><a name="L357"></a><tt class="py-lineno">357</tt> <a class="py-toggle" href="#" id="P4VMixin.addRecord-toggle" onclick="return toggle('P4VMixin.addRecord');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.P4VMixin-class.html#addRecord">addRecord</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">pm</tt><tt class="py-op">=</tt><tt class="py-name">None</tt><tt class="py-op">,</tt><tt class="py-param">keywords</tt><tt class="py-op">=</tt><tt class="py-name">None</tt><tt class="py-op">,</tt><tt class="py-param">name</tt><tt class="py-op">=</tt><tt class="py-name">None</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="P4VMixin.addRecord-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="P4VMixin.addRecord-expanded"><a name="L358"></a><tt class="py-lineno">358</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt class="py-name">pm</tt> <tt class="py-keyword">is</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L359"></a><tt class="py-lineno">359</tt>  <tt class="py-line">            <tt class="py-name">pm</tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">pm</tt> </tt>
<a name="L360"></a><tt class="py-lineno">360</tt>  <tt class="py-line">        <tt class="py-keyword">else</tt><tt class="py-op">:</tt> </tt>
<a name="L361"></a><tt class="py-lineno">361</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">pm</tt><tt class="py-op">=</tt><tt class="py-name">pm</tt> </tt>
<a name="L362"></a><tt class="py-lineno">362</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-155" class="py-name"><a title="p4vasp.db.UserManagementMixin.login" class="py-name" href="#" onclick="return doclink('link-155', 'login', 'link-148');">login</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L363"></a><tt class="py-lineno">363</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt id="link-156" class="py-name"><a title="p4vasp.applet.Applet.Applet.name" class="py-name" href="#" onclick="return doclink('link-156', 'name', 'link-12');">name</a></tt> <tt class="py-keyword">is</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L364"></a><tt class="py-lineno">364</tt>  <tt class="py-line">            <tt id="link-157" class="py-name"><a title="p4vasp.applet.Applet.Applet.name" class="py-name" href="#" onclick="return doclink('link-157', 'name', 'link-12');">name</a></tt>     <tt class="py-op">=</tt> <tt class="py-name">pm</tt><tt class="py-op">.</tt><tt class="py-name">NAME</tt> </tt>
<a name="L365"></a><tt class="py-lineno">365</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt id="link-158" class="py-name"><a title="p4vasp.applet.Applet.Applet.name" class="py-name" href="#" onclick="return doclink('link-158', 'name', 'link-12');">name</a></tt> <tt class="py-keyword">is</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L366"></a><tt class="py-lineno">366</tt>  <tt class="py-line">            <tt id="link-159" class="py-name"><a title="p4vasp.applet.Applet.Applet.name" class="py-name" href="#" onclick="return doclink('link-159', 'name', 'link-12');">name</a></tt><tt class="py-op">=</tt><tt class="py-string">""</tt> </tt>
<a name="L367"></a><tt class="py-lineno">367</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt class="py-name">keywords</tt> <tt class="py-keyword">is</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L368"></a><tt class="py-lineno">368</tt>  <tt class="py-line">            <tt class="py-name">keywords</tt> <tt class="py-op">=</tt> <tt class="py-name">pm</tt><tt class="py-op">.</tt><tt class="py-name">KEYWORDS</tt> </tt>
<a name="L369"></a><tt class="py-lineno">369</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt class="py-name">keywords</tt> <tt class="py-keyword">is</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L370"></a><tt class="py-lineno">370</tt>  <tt class="py-line">            <tt class="py-name">keywords</tt><tt class="py-op">=</tt><tt class="py-string">""</tt> </tt>
<a name="L371"></a><tt class="py-lineno">371</tt>  <tt class="py-line"> </tt>
<a name="L372"></a><tt class="py-lineno">372</tt>  <tt class="py-line">        <tt class="py-name">user_id</tt> <tt class="py-op">=</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">user_id</tt> </tt>
<a name="L373"></a><tt class="py-lineno">373</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt class="py-name">user_id</tt> <tt class="py-keyword">is</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L374"></a><tt class="py-lineno">374</tt>  <tt class="py-line">            <tt class="py-keyword">raise</tt> <tt class="py-name">Exception</tt><tt class="py-op">(</tt><tt class="py-string">"Can not login to %s"</tt><tt class="py-op">%</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-160" class="py-name"><a title="p4vasp.applet.Applet.Applet.name" class="py-name" href="#" onclick="return doclink('link-160', 'name', 'link-12');">name</a></tt><tt class="py-op">)</tt> </tt>
<a name="L375"></a><tt class="py-lineno">375</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">calc_id</tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-161" class="py-name" targets="Method p4vasp.db.DBI.insertRecord()=p4vasp.db.DBI-class.html#insertRecord"><a title="p4vasp.db.DBI.insertRecord" class="py-name" href="#" onclick="return doclink('link-161', 'insertRecord', 'link-161');">insertRecord</a></tt><tt class="py-op">(</tt><tt class="py-string">"#CALC"</tt><tt class="py-op">,</tt><tt class="py-string">"id"</tt><tt class="py-op">,</tt><tt class="py-string">"name,user_id,keywords"</tt><tt class="py-op">,</tt><tt class="py-string">'"%s",%d,"%s"'</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt id="link-162" class="py-name"><a title="p4vasp.applet.Applet.Applet.name" class="py-name" href="#" onclick="return doclink('link-162', 'name', 'link-12');">name</a></tt><tt class="py-op">,</tt><tt class="py-name">user_id</tt><tt class="py-op">,</tt><tt class="py-name">keywords</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L376"></a><tt class="py-lineno">376</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-163" class="py-name"><a title="p4vasp.db.DBI.commit
p4vasp.db.DBIContainer.commit
p4vasp.db.MySQLDBI.commit" class="py-name" href="#" onclick="return doclink('link-163', 'commit', 'link-67');">commit</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L377"></a><tt class="py-lineno">377</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">calc_id</tt> </tt>
</div><a name="L378"></a><tt class="py-lineno">378</tt>  <tt class="py-line"> </tt>
<a name="P4VMixin.storePMgen"></a><div id="P4VMixin.storePMgen-def"><a name="L379"></a><tt class="py-lineno">379</tt> <a class="py-toggle" href="#" id="P4VMixin.storePMgen-toggle" onclick="return toggle('P4VMixin.storePMgen');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.P4VMixin-class.html#storePMgen">storePMgen</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">pm</tt><tt class="py-op">,</tt><tt class="py-param">keywords</tt><tt class="py-op">=</tt><tt class="py-name">None</tt><tt class="py-op">,</tt><tt class="py-param">name</tt><tt class="py-op">=</tt><tt class="py-name">None</tt><tt class="py-op">,</tt> <tt class="py-param">date</tt><tt class="py-op">=</tt><tt class="py-name">None</tt><tt class="py-op">,</tt> <tt class="py-param">description</tt><tt class="py-op">=</tt><tt class="py-name">None</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="P4VMixin.storePMgen-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="P4VMixin.storePMgen-expanded"><a name="L380"></a><tt class="py-lineno">380</tt>  <tt class="py-line">        <tt class="py-keyword">import</tt> <tt id="link-164" class="py-name"><a title="p4vasp" class="py-name" href="#" onclick="return doclink('link-164', 'p4vasp', 'link-1');">p4vasp</a></tt><tt class="py-op">.</tt><tt id="link-165" class="py-name" targets="Module p4vasp.util=p4vasp.util-module.html"><a title="p4vasp.util" class="py-name" href="#" onclick="return doclink('link-165', 'util', 'link-165');">util</a></tt> </tt>
<a name="L381"></a><tt class="py-lineno">381</tt>  <tt class="py-line">        <tt class="py-keyword">import</tt> <tt id="link-166" class="py-name"><a title="p4vasp" class="py-name" href="#" onclick="return doclink('link-166', 'p4vasp', 'link-1');">p4vasp</a></tt> </tt>
<a name="L382"></a><tt class="py-lineno">382</tt>  <tt class="py-line">        <tt class="py-keyword">import</tt> <tt class="py-name">time</tt> </tt>
<a name="L383"></a><tt class="py-lineno">383</tt>  <tt class="py-line">        <tt class="py-name">calc_id</tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-167" class="py-name" targets="Method p4vasp.db.P4VMixin.addRecord()=p4vasp.db.P4VMixin-class.html#addRecord"><a title="p4vasp.db.P4VMixin.addRecord" class="py-name" href="#" onclick="return doclink('link-167', 'addRecord', 'link-167');">addRecord</a></tt><tt class="py-op">(</tt><tt class="py-name">pm</tt><tt class="py-op">,</tt><tt class="py-name">keywords</tt><tt class="py-op">=</tt><tt class="py-name">keywords</tt><tt class="py-op">,</tt><tt id="link-168" class="py-name"><a title="p4vasp.applet.Applet.Applet.name" class="py-name" href="#" onclick="return doclink('link-168', 'name', 'link-12');">name</a></tt><tt class="py-op">=</tt><tt id="link-169" class="py-name"><a title="p4vasp.applet.Applet.Applet.name" class="py-name" href="#" onclick="return doclink('link-169', 'name', 'link-12');">name</a></tt><tt class="py-op">)</tt> </tt>
<a name="L384"></a><tt class="py-lineno">384</tt>  <tt class="py-line">        <tt id="link-170" class="py-name"><a title="p4vasp.msg" class="py-name" href="#" onclick="return doclink('link-170', 'msg', 'link-137');">msg</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">.</tt><tt id="link-171" class="py-name" targets="Method p4vasp.message.MessageDriver.status()=p4vasp.message.MessageDriver-class.html#status,Method p4vasp.schedule'.Process.status()=p4vasp.schedule%27.Process-class.html#status"><a title="p4vasp.message.MessageDriver.status
p4vasp.schedule'.Process.status" class="py-name" href="#" onclick="return doclink('link-171', 'status', 'link-171');">status</a></tt><tt class="py-op">(</tt><tt class="py-string">"Store calculation %s to database %s."</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt id="link-172" class="py-name"><a title="p4vasp.applet.Applet.Applet.name" class="py-name" href="#" onclick="return doclink('link-172', 'name', 'link-12');">name</a></tt><tt class="py-op">,</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-173" class="py-name"><a title="p4vasp.applet.Applet.Applet.name" class="py-name" href="#" onclick="return doclink('link-173', 'name', 'link-12');">name</a></tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L385"></a><tt class="py-lineno">385</tt>  <tt class="py-line">        <tt class="py-keyword">yield</tt> <tt class="py-number">1</tt> </tt>
<a name="L386"></a><tt class="py-lineno">386</tt>  <tt class="py-line">        <tt class="py-keyword">try</tt><tt class="py-op">:</tt> </tt>
<a name="L387"></a><tt class="py-lineno">387</tt>  <tt class="py-line">            <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">pm</tt><tt class="py-op">.</tt><tt class="py-name">PATH</tt> </tt>
<a name="L388"></a><tt class="py-lineno">388</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">s</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt> <tt class="py-keyword">and</tt> <tt class="py-string">'"'</tt> <tt class="py-keyword">not</tt> <tt class="py-keyword">in</tt> <tt class="py-name">s</tt> <tt class="py-keyword">and</tt> <tt class="py-string">"'"</tt> <tt class="py-keyword">not</tt> <tt class="py-keyword">in</tt> <tt class="py-name">s</tt><tt class="py-op">:</tt> </tt>
<a name="L389"></a><tt class="py-lineno">389</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-174" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-174', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">'UPDATE #CALC SET path="%s" WHERE id=%d'</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">str</tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt><tt class="py-op">,</tt><tt class="py-name">calc_id</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L390"></a><tt class="py-lineno">390</tt>  <tt class="py-line">            <tt class="py-keyword">else</tt><tt class="py-op">:</tt> </tt>
<a name="L391"></a><tt class="py-lineno">391</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-175" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-175', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">'UPDATE #CALC SET path=NULL WHERE id=%d'</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">calc_id</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L392"></a><tt class="py-lineno">392</tt>  <tt class="py-line"> </tt>
<a name="L393"></a><tt class="py-lineno">393</tt>  <tt class="py-line">            <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">pm</tt><tt class="py-op">.</tt><tt class="py-name">KPOINTS_TEXT</tt> </tt>
<a name="L394"></a><tt class="py-lineno">394</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">s</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L395"></a><tt class="py-lineno">395</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">replace</tt><tt class="py-op">(</tt><tt class="py-string">"'"</tt><tt class="py-op">,</tt><tt class="py-string">""</tt><tt class="py-op">)</tt> </tt>
<a name="L396"></a><tt class="py-lineno">396</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">replace</tt><tt class="py-op">(</tt><tt class="py-string">'"'</tt><tt class="py-op">,</tt><tt class="py-string">""</tt><tt class="py-op">)</tt> </tt>
<a name="L397"></a><tt class="py-lineno">397</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-176" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-176', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">'UPDATE #CALC SET kpoints_text="%s" WHERE id=%d'</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">str</tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt><tt class="py-op">,</tt><tt class="py-name">calc_id</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L398"></a><tt class="py-lineno">398</tt>  <tt class="py-line">            <tt class="py-keyword">else</tt><tt class="py-op">:</tt> </tt>
<a name="L399"></a><tt class="py-lineno">399</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-177" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-177', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">'UPDATE #CALC SET kpoints_text=NULL WHERE id=%d'</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">calc_id</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L400"></a><tt class="py-lineno">400</tt>  <tt class="py-line"> </tt>
<a name="L401"></a><tt class="py-lineno">401</tt>  <tt class="py-line">            <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">date</tt> </tt>
<a name="L402"></a><tt class="py-lineno">402</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">s</tt> <tt class="py-keyword">is</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L403"></a><tt class="py-lineno">403</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">pm</tt><tt class="py-op">.</tt><tt class="py-name">DATE</tt> </tt>
<a name="L404"></a><tt class="py-lineno">404</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">s</tt> <tt class="py-keyword">is</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L405"></a><tt class="py-lineno">405</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">time</tt><tt class="py-op">.</tt><tt class="py-name">localtime</tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L406"></a><tt class="py-lineno">406</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">type</tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt> <tt class="py-op">!=</tt> <tt class="py-name">type</tt><tt class="py-op">(</tt><tt class="py-string">""</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L407"></a><tt class="py-lineno">407</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">time</tt><tt class="py-op">.</tt><tt class="py-name">strftime</tt><tt class="py-op">(</tt><tt class="py-string">"%Y-%m-%d %H:%M:%S"</tt><tt class="py-op">,</tt><tt class="py-name">s</tt><tt class="py-op">)</tt> </tt>
<a name="L408"></a><tt class="py-lineno">408</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-178" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-178', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">'UPDATE #CALC SET cdatetime="%s" WHERE id=%d'</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">,</tt><tt class="py-name">calc_id</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L409"></a><tt class="py-lineno">409</tt>  <tt class="py-line"> </tt>
<a name="L410"></a><tt class="py-lineno">410</tt>  <tt class="py-line">            <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">pm</tt><tt class="py-op">.</tt><tt class="py-name">FREE_ENERGY</tt> </tt>
<a name="L411"></a><tt class="py-lineno">411</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">s</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L412"></a><tt class="py-lineno">412</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt id="link-179" class="py-name" targets="Class float=float-class.html"><a title="float" class="py-name" href="#" onclick="return doclink('link-179', 'float', 'link-179');">float</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt> </tt>
<a name="L413"></a><tt class="py-lineno">413</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-180" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-180', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">'UPDATE #CALC SET free_energy=%f WHERE id=%d'</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">,</tt><tt class="py-name">calc_id</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L414"></a><tt class="py-lineno">414</tt>  <tt class="py-line"> </tt>
<a name="L415"></a><tt class="py-lineno">415</tt>  <tt class="py-line">            <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">pm</tt><tt class="py-op">.</tt><tt class="py-name">E_FERMI</tt> </tt>
<a name="L416"></a><tt class="py-lineno">416</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">s</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L417"></a><tt class="py-lineno">417</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt id="link-181" class="py-name"><a title="float" class="py-name" href="#" onclick="return doclink('link-181', 'float', 'link-179');">float</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt> </tt>
<a name="L418"></a><tt class="py-lineno">418</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-182" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-182', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">'UPDATE #CALC SET fermi_energy=%f WHERE id=%d'</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">,</tt><tt class="py-name">calc_id</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L419"></a><tt class="py-lineno">419</tt>  <tt class="py-line"> </tt>
<a name="L420"></a><tt class="py-lineno">420</tt>  <tt class="py-line">            <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">description</tt> </tt>
<a name="L421"></a><tt class="py-lineno">421</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">s</tt> <tt class="py-keyword">is</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L422"></a><tt class="py-lineno">422</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">pm</tt><tt class="py-op">.</tt><tt class="py-name">DESCRIPTION</tt> </tt>
<a name="L423"></a><tt class="py-lineno">423</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">s</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L424"></a><tt class="py-lineno">424</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">str</tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt> </tt>
<a name="L425"></a><tt class="py-lineno">425</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">replace</tt><tt class="py-op">(</tt><tt class="py-string">'"'</tt><tt class="py-op">,</tt><tt class="py-string">" "</tt><tt class="py-op">)</tt> </tt>
<a name="L426"></a><tt class="py-lineno">426</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">replace</tt><tt class="py-op">(</tt><tt class="py-string">"'"</tt><tt class="py-op">,</tt><tt class="py-string">" "</tt><tt class="py-op">)</tt> </tt>
<a name="L427"></a><tt class="py-lineno">427</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">replace</tt><tt class="py-op">(</tt><tt class="py-string">"\\"</tt><tt class="py-op">,</tt><tt class="py-string">" "</tt><tt class="py-op">)</tt> </tt>
<a name="L428"></a><tt class="py-lineno">428</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-183" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-183', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">'UPDATE #CALC SET description="%s" WHERE id=%d'</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">,</tt><tt class="py-name">calc_id</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L429"></a><tt class="py-lineno">429</tt>  <tt class="py-line"> </tt>
<a name="L430"></a><tt class="py-lineno">430</tt>  <tt class="py-line">            <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">pm</tt><tt class="py-op">.</tt><tt class="py-name">PROGRAM</tt> </tt>
<a name="L431"></a><tt class="py-lineno">431</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">s</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L432"></a><tt class="py-lineno">432</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">str</tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt> </tt>
<a name="L433"></a><tt class="py-lineno">433</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">replace</tt><tt class="py-op">(</tt><tt class="py-string">'"'</tt><tt class="py-op">,</tt><tt class="py-string">" "</tt><tt class="py-op">)</tt> </tt>
<a name="L434"></a><tt class="py-lineno">434</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">replace</tt><tt class="py-op">(</tt><tt class="py-string">"'"</tt><tt class="py-op">,</tt><tt class="py-string">" "</tt><tt class="py-op">)</tt> </tt>
<a name="L435"></a><tt class="py-lineno">435</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">replace</tt><tt class="py-op">(</tt><tt class="py-string">"\\"</tt><tt class="py-op">,</tt><tt class="py-string">" "</tt><tt class="py-op">)</tt> </tt>
<a name="L436"></a><tt class="py-lineno">436</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-184" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-184', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">'UPDATE #CALC SET program="%s" WHERE id=%d'</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">,</tt><tt class="py-name">calc_id</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L437"></a><tt class="py-lineno">437</tt>  <tt class="py-line"> </tt>
<a name="L438"></a><tt class="py-lineno">438</tt>  <tt class="py-line">            <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">pm</tt><tt class="py-op">.</tt><tt class="py-name">VERSION</tt> </tt>
<a name="L439"></a><tt class="py-lineno">439</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">s</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L440"></a><tt class="py-lineno">440</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">str</tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt> </tt>
<a name="L441"></a><tt class="py-lineno">441</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">replace</tt><tt class="py-op">(</tt><tt class="py-string">'"'</tt><tt class="py-op">,</tt><tt class="py-string">" "</tt><tt class="py-op">)</tt> </tt>
<a name="L442"></a><tt class="py-lineno">442</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">replace</tt><tt class="py-op">(</tt><tt class="py-string">"'"</tt><tt class="py-op">,</tt><tt class="py-string">" "</tt><tt class="py-op">)</tt> </tt>
<a name="L443"></a><tt class="py-lineno">443</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">replace</tt><tt class="py-op">(</tt><tt class="py-string">"\\"</tt><tt class="py-op">,</tt><tt class="py-string">" "</tt><tt class="py-op">)</tt> </tt>
<a name="L444"></a><tt class="py-lineno">444</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-185" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-185', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">'UPDATE #CALC SET version="%s" WHERE id=%d'</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">,</tt><tt class="py-name">calc_id</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L445"></a><tt class="py-lineno">445</tt>  <tt class="py-line"> </tt>
<a name="L446"></a><tt class="py-lineno">446</tt>  <tt class="py-line">            <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">pm</tt><tt class="py-op">.</tt><tt class="py-name">SUBVERSION</tt> </tt>
<a name="L447"></a><tt class="py-lineno">447</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">s</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L448"></a><tt class="py-lineno">448</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">str</tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt> </tt>
<a name="L449"></a><tt class="py-lineno">449</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">replace</tt><tt class="py-op">(</tt><tt class="py-string">'"'</tt><tt class="py-op">,</tt><tt class="py-string">" "</tt><tt class="py-op">)</tt> </tt>
<a name="L450"></a><tt class="py-lineno">450</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">replace</tt><tt class="py-op">(</tt><tt class="py-string">"'"</tt><tt class="py-op">,</tt><tt class="py-string">" "</tt><tt class="py-op">)</tt> </tt>
<a name="L451"></a><tt class="py-lineno">451</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">replace</tt><tt class="py-op">(</tt><tt class="py-string">"\\"</tt><tt class="py-op">,</tt><tt class="py-string">" "</tt><tt class="py-op">)</tt> </tt>
<a name="L452"></a><tt class="py-lineno">452</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-186" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-186', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">'UPDATE #CALC SET subversion="%s" WHERE id=%d'</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">,</tt><tt class="py-name">calc_id</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L453"></a><tt class="py-lineno">453</tt>  <tt class="py-line"> </tt>
<a name="L454"></a><tt class="py-lineno">454</tt>  <tt class="py-line">            <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">pm</tt><tt class="py-op">.</tt><tt class="py-name">PLATFORM</tt> </tt>
<a name="L455"></a><tt class="py-lineno">455</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">s</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L456"></a><tt class="py-lineno">456</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">str</tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt> </tt>
<a name="L457"></a><tt class="py-lineno">457</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">replace</tt><tt class="py-op">(</tt><tt class="py-string">'"'</tt><tt class="py-op">,</tt><tt class="py-string">" "</tt><tt class="py-op">)</tt> </tt>
<a name="L458"></a><tt class="py-lineno">458</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">replace</tt><tt class="py-op">(</tt><tt class="py-string">"'"</tt><tt class="py-op">,</tt><tt class="py-string">" "</tt><tt class="py-op">)</tt> </tt>
<a name="L459"></a><tt class="py-lineno">459</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">replace</tt><tt class="py-op">(</tt><tt class="py-string">"\\"</tt><tt class="py-op">,</tt><tt class="py-string">" "</tt><tt class="py-op">)</tt> </tt>
<a name="L460"></a><tt class="py-lineno">460</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-187" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-187', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">'UPDATE #CALC SET platform="%s" WHERE id=%d'</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">,</tt><tt class="py-name">calc_id</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L461"></a><tt class="py-lineno">461</tt>  <tt class="py-line"> </tt>
<a name="L462"></a><tt class="py-lineno">462</tt>  <tt class="py-line">            <tt class="py-name">incar</tt> <tt class="py-op">=</tt> <tt class="py-name">pm</tt><tt class="py-op">.</tt><tt class="py-name">INCAR</tt> </tt>
<a name="L463"></a><tt class="py-lineno">463</tt>  <tt class="py-line">            <tt class="py-name">parameters</tt> <tt class="py-op">=</tt> <tt class="py-name">pm</tt><tt class="py-op">.</tt><tt class="py-name">PARAMETERS</tt> </tt>
<a name="L464"></a><tt class="py-lineno">464</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">incar</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L465"></a><tt class="py-lineno">465</tt>  <tt class="py-line">                <tt class="py-keyword">if</tt> <tt class="py-name">parameters</tt> <tt class="py-keyword">is</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L466"></a><tt class="py-lineno">466</tt>  <tt class="py-line">                    <tt class="py-name">parameters</tt><tt class="py-op">=</tt><tt class="py-name">incar</tt> </tt>
<a name="L467"></a><tt class="py-lineno">467</tt>  <tt class="py-line">                <tt class="py-keyword">for</tt> <tt class="py-name">key</tt><tt class="py-op">,</tt><tt class="py-name">value</tt> <tt class="py-keyword">in</tt> <tt class="py-name">parameters</tt><tt class="py-op">.</tt><tt id="link-188" class="py-name"><a title="p4vasp.Dictionary.StructuredDictionary.items
p4vasp.ODPdom.AttributeList.items
p4vasp.ODPdom.NamedNodeMap.items" class="py-name" href="#" onclick="return doclink('link-188', 'items', 'link-23');">items</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L468"></a><tt class="py-lineno">468</tt>  <tt class="py-line">                    <tt id="link-189" class="py-name"><a title="p4vasp.msg" class="py-name" href="#" onclick="return doclink('link-189', 'msg', 'link-137');">msg</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">.</tt><tt id="link-190" class="py-name"><a title="p4vasp.message.MessageDriver.status
p4vasp.schedule'.Process.status" class="py-name" href="#" onclick="return doclink('link-190', 'status', 'link-171');">status</a></tt><tt class="py-op">(</tt><tt class="py-string">"Store parameters (%s)"</tt><tt class="py-op">%</tt><tt class="py-name">key</tt><tt class="py-op">)</tt> </tt>
<a name="L469"></a><tt class="py-lineno">469</tt>  <tt class="py-line">                    <tt class="py-keyword">yield</tt> <tt class="py-number">1</tt> </tt>
<a name="L470"></a><tt class="py-lineno">470</tt>  <tt class="py-line">                    <tt class="py-name">fieldtype</tt>   <tt class="py-op">=</tt> <tt class="py-name">parameters</tt><tt class="py-op">.</tt><tt id="link-191" class="py-name" targets="Method p4vasp.Array.Array.getFieldType()=p4vasp.Array.Array-class.html#getFieldType,Method p4vasp.Dictionary.Dictionary.getFieldType()=p4vasp.Dictionary.Dictionary-class.html#getFieldType,Method p4vasp.Dictionary.StructuredDictionary.getFieldType()=p4vasp.Dictionary.StructuredDictionary-class.html#getFieldType"><a title="p4vasp.Array.Array.getFieldType
p4vasp.Dictionary.Dictionary.getFieldType
p4vasp.Dictionary.StructuredDictionary.getFieldType" class="py-name" href="#" onclick="return doclink('link-191', 'getFieldType', 'link-191');">getFieldType</a></tt><tt class="py-op">(</tt><tt class="py-name">key</tt><tt class="py-op">)</tt> </tt>
<a name="L471"></a><tt class="py-lineno">471</tt>  <tt class="py-line">                    <tt class="py-name">isarray</tt>     <tt class="py-op">=</tt> <tt id="link-192" class="py-name"><a title="p4vasp" class="py-name" href="#" onclick="return doclink('link-192', 'p4vasp', 'link-1');">p4vasp</a></tt><tt class="py-op">.</tt><tt id="link-193" class="py-name"><a title="p4vasp.util" class="py-name" href="#" onclick="return doclink('link-193', 'util', 'link-165');">util</a></tt><tt class="py-op">.</tt><tt id="link-194" class="py-name" targets="Function p4vasp.util.isArray()=p4vasp.util-module.html#isArray"><a title="p4vasp.util.isArray" class="py-name" href="#" onclick="return doclink('link-194', 'isArray', 'link-194');">isArray</a></tt><tt class="py-op">(</tt><tt class="py-name">value</tt><tt class="py-op">)</tt> </tt>
<a name="L472"></a><tt class="py-lineno">472</tt>  <tt class="py-line">                    <tt class="py-name">isspecified</tt> <tt class="py-op">=</tt> <tt class="py-name">int</tt><tt class="py-op">(</tt><tt class="py-name">incar</tt><tt class="py-op">.</tt><tt id="link-195" class="py-name"><a title="p4vasp.Dictionary.StructuredDictionary.has_key" class="py-name" href="#" onclick="return doclink('link-195', 'has_key', 'link-17');">has_key</a></tt><tt class="py-op">(</tt><tt class="py-name">key</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L473"></a><tt class="py-lineno">473</tt>  <tt class="py-line">                    <tt class="py-keyword">if</tt> <tt class="py-name">isarray</tt><tt class="py-op">:</tt> </tt>
<a name="L474"></a><tt class="py-lineno">474</tt>  <tt class="py-line">                        <tt class="py-keyword">if</tt> <tt class="py-name">fieldtype</tt> <tt class="py-op">==</tt> <tt id="link-196" class="py-name"><a title="p4vasp" class="py-name" href="#" onclick="return doclink('link-196', 'p4vasp', 'link-1');">p4vasp</a></tt><tt class="py-op">.</tt><tt id="link-197" class="py-name" targets="Variable p4vasp.Array.LOGICAL_TYPE=p4vasp.Array-module.html#LOGICAL_TYPE,Variable p4vasp.Dictionary.LOGICAL_TYPE=p4vasp.Dictionary-module.html#LOGICAL_TYPE,Variable p4vasp.GraphCanvas.LOGICAL_TYPE=p4vasp.GraphCanvas-module.html#LOGICAL_TYPE,Variable p4vasp.GraphPM.LOGICAL_TYPE=p4vasp.GraphPM-module.html#LOGICAL_TYPE,Variable p4vasp.LOGICAL_TYPE=p4vasp-module.html#LOGICAL_TYPE,Variable p4vasp.Property.LOGICAL_TYPE=p4vasp.Property-module.html#LOGICAL_TYPE,Variable p4vasp.Structure.LOGICAL_TYPE=p4vasp.Structure-module.html#LOGICAL_TYPE,Variable p4vasp.graph.LOGICAL_TYPE=p4vasp.graph-module.html#LOGICAL_TYPE,Variable p4vasp.repository.LOGICAL_TYPE=p4vasp.repository-module.html#LOGICAL_TYPE,Variable p4vasp.util.LOGICAL_TYPE=p4vasp.util-module.html#LOGICAL_TYPE"><a title="p4vasp.Array.LOGICAL_TYPE
p4vasp.Dictionary.LOGICAL_TYPE
p4vasp.GraphCanvas.LOGICAL_TYPE
p4vasp.GraphPM.LOGICAL_TYPE
p4vasp.LOGICAL_TYPE
p4vasp.Property.LOGICAL_TYPE
p4vasp.Structure.LOGICAL_TYPE
p4vasp.graph.LOGICAL_TYPE
p4vasp.repository.LOGICAL_TYPE
p4vasp.util.LOGICAL_TYPE" class="py-name" href="#" onclick="return doclink('link-197', 'LOGICAL_TYPE', 'link-197');">LOGICAL_TYPE</a></tt><tt class="py-op">:</tt> </tt>
<a name="L475"></a><tt class="py-lineno">475</tt>  <tt class="py-line">                            <tt class="py-name">value</tt> <tt class="py-op">=</tt> <tt class="py-name">map</tt><tt class="py-op">(</tt><tt class="py-name">int</tt><tt class="py-op">,</tt><tt class="py-name">value</tt><tt class="py-op">)</tt> </tt>
<a name="L476"></a><tt class="py-lineno">476</tt>  <tt class="py-line">                        <tt class="py-name">svalue</tt> <tt class="py-op">=</tt> <tt class="py-string">' '</tt><tt class="py-op">.</tt><tt class="py-name">join</tt><tt class="py-op">(</tt><tt class="py-name">map</tt><tt class="py-op">(</tt><tt class="py-name">str</tt><tt class="py-op">,</tt><tt class="py-name">value</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L477"></a><tt class="py-lineno">477</tt>  <tt class="py-line">                    <tt class="py-keyword">else</tt><tt class="py-op">:</tt> </tt>
<a name="L478"></a><tt class="py-lineno">478</tt>  <tt class="py-line">                        <tt class="py-keyword">if</tt> <tt class="py-name">fieldtype</tt> <tt class="py-op">==</tt> <tt id="link-198" class="py-name"><a title="p4vasp" class="py-name" href="#" onclick="return doclink('link-198', 'p4vasp', 'link-1');">p4vasp</a></tt><tt class="py-op">.</tt><tt id="link-199" class="py-name"><a title="p4vasp.Array.LOGICAL_TYPE
p4vasp.Dictionary.LOGICAL_TYPE
p4vasp.GraphCanvas.LOGICAL_TYPE
p4vasp.GraphPM.LOGICAL_TYPE
p4vasp.LOGICAL_TYPE
p4vasp.Property.LOGICAL_TYPE
p4vasp.Structure.LOGICAL_TYPE
p4vasp.graph.LOGICAL_TYPE
p4vasp.repository.LOGICAL_TYPE
p4vasp.util.LOGICAL_TYPE" class="py-name" href="#" onclick="return doclink('link-199', 'LOGICAL_TYPE', 'link-197');">LOGICAL_TYPE</a></tt><tt class="py-op">:</tt> </tt>
<a name="L479"></a><tt class="py-lineno">479</tt>  <tt class="py-line">                            <tt class="py-name">value</tt> <tt class="py-op">=</tt> <tt class="py-name">int</tt><tt class="py-op">(</tt><tt class="py-name">value</tt><tt class="py-op">)</tt> </tt>
<a name="L480"></a><tt class="py-lineno">480</tt>  <tt class="py-line">                        <tt class="py-name">svalue</tt> <tt class="py-op">=</tt> <tt class="py-name">str</tt><tt class="py-op">(</tt><tt class="py-name">value</tt><tt class="py-op">)</tt> </tt>
<a name="L481"></a><tt class="py-lineno">481</tt>  <tt class="py-line">                    <tt class="py-keyword">if</tt> <tt id="link-200" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-200', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">svalue</tt><tt class="py-op">)</tt><tt class="py-op">&gt;</tt><tt class="py-number">254</tt><tt class="py-op">:</tt> </tt>
<a name="L482"></a><tt class="py-lineno">482</tt>  <tt class="py-line">                        <tt class="py-name">textvalue</tt><tt class="py-op">=</tt><tt class="py-string">'"'</tt><tt class="py-op">+</tt><tt class="py-name">svalue</tt><tt class="py-op">+</tt><tt class="py-string">'"'</tt> </tt>
<a name="L483"></a><tt class="py-lineno">483</tt>  <tt class="py-line">                        <tt class="py-name">svalue</tt><tt class="py-op">=</tt><tt class="py-string">"NULL"</tt> </tt>
<a name="L484"></a><tt class="py-lineno">484</tt>  <tt class="py-line">                    <tt class="py-keyword">else</tt><tt class="py-op">:</tt> </tt>
<a name="L485"></a><tt class="py-lineno">485</tt>  <tt class="py-line">                        <tt class="py-name">svalue</tt><tt class="py-op">=</tt><tt class="py-string">'"'</tt><tt class="py-op">+</tt><tt class="py-name">svalue</tt><tt class="py-op">+</tt><tt class="py-string">'"'</tt> </tt>
<a name="L486"></a><tt class="py-lineno">486</tt>  <tt class="py-line">                        <tt class="py-name">textvalue</tt><tt class="py-op">=</tt><tt class="py-string">"NULL"</tt> </tt>
<a name="L487"></a><tt class="py-lineno">487</tt>  <tt class="py-line">                    <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-201" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-201', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">'INSERT INTO #PARAMETERS '</tt> </tt>
<a name="L488"></a><tt class="py-lineno">488</tt>  <tt class="py-line">                             <tt class="py-string">'(calc_id, name, fieldtype, isarray, isspecified, value, textvalue) '</tt> </tt>
<a name="L489"></a><tt class="py-lineno">489</tt>  <tt class="py-line">                             <tt class="py-string">'VALUES (%d, "%s", "%s", %d, %d, %s, %s)'</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">calc_id</tt><tt class="py-op">,</tt> <tt class="py-name">key</tt><tt class="py-op">,</tt> <tt class="py-name">fieldtype</tt><tt class="py-op">,</tt> <tt class="py-name">isarray</tt><tt class="py-op">,</tt> <tt class="py-name">isspecified</tt><tt class="py-op">,</tt> <tt class="py-name">svalue</tt><tt class="py-op">,</tt> <tt class="py-name">textvalue</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L490"></a><tt class="py-lineno">490</tt>  <tt class="py-line"> </tt>
<a name="L491"></a><tt class="py-lineno">491</tt>  <tt class="py-line">            <tt class="py-name">dos</tt><tt class="py-op">=</tt><tt class="py-name">pm</tt><tt class="py-op">.</tt><tt class="py-name">TOTAL_DOS</tt> </tt>
<a name="L492"></a><tt class="py-lineno">492</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">dos</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L493"></a><tt class="py-lineno">493</tt>  <tt class="py-line">                <tt id="link-202" class="py-name"><a title="p4vasp.msg" class="py-name" href="#" onclick="return doclink('link-202', 'msg', 'link-137');">msg</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">.</tt><tt id="link-203" class="py-name"><a title="p4vasp.message.MessageDriver.status
p4vasp.schedule'.Process.status" class="py-name" href="#" onclick="return doclink('link-203', 'status', 'link-171');">status</a></tt><tt class="py-op">(</tt><tt class="py-string">"Store total DOS"</tt><tt class="py-op">)</tt> </tt>
<a name="L494"></a><tt class="py-lineno">494</tt>  <tt class="py-line">                <tt class="py-keyword">yield</tt> <tt class="py-number">1</tt> </tt>
<a name="L495"></a><tt class="py-lineno">495</tt>  <tt class="py-line">                <tt class="py-keyword">if</tt> <tt id="link-204" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-204', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">dos</tt><tt class="py-op">)</tt><tt class="py-op">==</tt><tt class="py-number">1</tt><tt class="py-op">:</tt> </tt>
<a name="L496"></a><tt class="py-lineno">496</tt>  <tt class="py-line">                    <tt class="py-name">spins</tt><tt class="py-op">=</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt> </tt>
<a name="L497"></a><tt class="py-lineno">497</tt>  <tt class="py-line">                <tt class="py-keyword">elif</tt> <tt id="link-205" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-205', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">dos</tt><tt class="py-op">)</tt><tt class="py-op">==</tt><tt class="py-number">2</tt><tt class="py-op">:</tt> </tt>
<a name="L498"></a><tt class="py-lineno">498</tt>  <tt class="py-line">                    <tt class="py-name">spins</tt><tt class="py-op">=</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">,</tt><tt class="py-number">2</tt><tt class="py-op">]</tt> </tt>
<a name="L499"></a><tt class="py-lineno">499</tt>  <tt class="py-line">                <tt class="py-keyword">else</tt><tt class="py-op">:</tt> </tt>
<a name="L500"></a><tt class="py-lineno">500</tt>  <tt class="py-line">                    <tt class="py-name">spins</tt><tt class="py-op">=</tt><tt class="py-op">[</tt><tt class="py-op">-</tt><tt class="py-number">1</tt><tt class="py-op">,</tt><tt class="py-op">-</tt><tt class="py-number">2</tt><tt class="py-op">,</tt><tt class="py-op">-</tt><tt class="py-number">3</tt><tt class="py-op">,</tt><tt class="py-op">-</tt><tt class="py-number">4</tt><tt class="py-op">]</tt> </tt>
<a name="L501"></a><tt class="py-lineno">501</tt>  <tt class="py-line">                <tt class="py-name">progress</tt><tt class="py-op">=</tt><tt class="py-number">0</tt> </tt>
<a name="L502"></a><tt class="py-lineno">502</tt>  <tt class="py-line">                <tt id="link-206" class="py-name" targets="Method p4vasp.schedule'.Process.total()=p4vasp.schedule%27.Process-class.html#total"><a title="p4vasp.schedule'.Process.total" class="py-name" href="#" onclick="return doclink('link-206', 'total', 'link-206');">total</a></tt><tt class="py-op">=</tt><tt id="link-207" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-207', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">dos</tt><tt class="py-op">)</tt><tt class="py-op">*</tt><tt id="link-208" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-208', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">dos</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">)</tt> </tt>
<a name="L503"></a><tt class="py-lineno">503</tt>  <tt class="py-line">                <tt class="py-keyword">for</tt> <tt class="py-name">s</tt> <tt class="py-keyword">in</tt> <tt class="py-name">xrange</tt><tt class="py-op">(</tt><tt id="link-209" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-209', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">dos</tt><tt class="py-op">)</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L504"></a><tt class="py-lineno">504</tt>  <tt class="py-line">                    <tt id="link-210" class="py-name" targets="Method p4vasp.applet.STMWindowControlApplet.STMWindowControlApplet.sd()=p4vasp.applet.STMWindowControlApplet.STMWindowControlApplet-class.html#sd"><a title="p4vasp.applet.STMWindowControlApplet.STMWindowControlApplet.sd" class="py-name" href="#" onclick="return doclink('link-210', 'sd', 'link-210');">sd</a></tt><tt class="py-op">=</tt><tt class="py-name">dos</tt><tt class="py-op">[</tt><tt class="py-name">s</tt><tt class="py-op">]</tt> </tt>
<a name="L505"></a><tt class="py-lineno">505</tt>  <tt class="py-line">                    <tt class="py-keyword">for</tt> <tt id="link-211" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-211', 'i', 'link-73');">i</a></tt> <tt class="py-keyword">in</tt> <tt class="py-name">xrange</tt><tt class="py-op">(</tt><tt id="link-212" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-212', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt id="link-213" class="py-name"><a title="p4vasp.applet.STMWindowControlApplet.STMWindowControlApplet.sd" class="py-name" href="#" onclick="return doclink('link-213', 'sd', 'link-210');">sd</a></tt><tt class="py-op">)</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L506"></a><tt class="py-lineno">506</tt>  <tt class="py-line">                        <tt class="py-name">sdi</tt><tt class="py-op">=</tt><tt id="link-214" class="py-name"><a title="p4vasp.applet.STMWindowControlApplet.STMWindowControlApplet.sd" class="py-name" href="#" onclick="return doclink('link-214', 'sd', 'link-210');">sd</a></tt><tt class="py-op">[</tt><tt id="link-215" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-215', 'i', 'link-73');">i</a></tt><tt class="py-op">]</tt> </tt>
<a name="L507"></a><tt class="py-lineno">507</tt>  <tt class="py-line">                        <tt class="py-name">energy</tt>     <tt class="py-op">=</tt><tt class="py-name">sdi</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt> </tt>
<a name="L508"></a><tt class="py-lineno">508</tt>  <tt class="py-line">                        <tt class="py-name">density</tt>    <tt class="py-op">=</tt><tt class="py-name">sdi</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">]</tt> </tt>
<a name="L509"></a><tt class="py-lineno">509</tt>  <tt class="py-line">                        <tt class="py-name">integrated</tt> <tt class="py-op">=</tt><tt class="py-name">sdi</tt><tt class="py-op">[</tt><tt class="py-number">2</tt><tt class="py-op">]</tt> </tt>
<a name="L510"></a><tt class="py-lineno">510</tt>  <tt class="py-line">                        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-216" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-216', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">'INSERT INTO #DOS (calc_id,spin,energy,density,integrated) VALUES (%d, %d, %f, %f, %f)'</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">calc_id</tt><tt class="py-op">,</tt><tt class="py-name">spins</tt><tt class="py-op">[</tt><tt class="py-name">s</tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt class="py-name">energy</tt><tt class="py-op">,</tt><tt class="py-name">density</tt><tt class="py-op">,</tt><tt class="py-name">integrated</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L511"></a><tt class="py-lineno">511</tt>  <tt class="py-line">                        <tt class="py-name">progress</tt><tt class="py-op">+=</tt><tt class="py-number">1</tt> </tt>
<a name="L512"></a><tt class="py-lineno">512</tt>  <tt class="py-line">                        <tt class="py-keyword">if</tt> <tt class="py-keyword">not</tt> <tt class="py-name">progress</tt><tt class="py-op">%</tt><tt class="py-number">10</tt><tt class="py-op">:</tt> </tt>
<a name="L513"></a><tt class="py-lineno">513</tt>  <tt class="py-line">                            <tt id="link-217" class="py-name"><a title="p4vasp.msg" class="py-name" href="#" onclick="return doclink('link-217', 'msg', 'link-137');">msg</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">.</tt><tt id="link-218" class="py-name" targets="Method p4vasp.message.MessageDriver.step()=p4vasp.message.MessageDriver-class.html#step,Method p4vasp.schedule'.Process.step()=p4vasp.schedule%27.Process-class.html#step"><a title="p4vasp.message.MessageDriver.step
p4vasp.schedule'.Process.step" class="py-name" href="#" onclick="return doclink('link-218', 'step', 'link-218');">step</a></tt><tt class="py-op">(</tt><tt class="py-name">progress</tt><tt class="py-op">,</tt><tt id="link-219" class="py-name"><a title="p4vasp.schedule'.Process.total" class="py-name" href="#" onclick="return doclink('link-219', 'total', 'link-206');">total</a></tt><tt class="py-op">)</tt> </tt>
<a name="L514"></a><tt class="py-lineno">514</tt>  <tt class="py-line">                            <tt class="py-keyword">yield</tt> <tt class="py-number">1</tt> </tt>
<a name="L515"></a><tt class="py-lineno">515</tt>  <tt class="py-line">                <tt id="link-220" class="py-name"><a title="p4vasp.msg" class="py-name" href="#" onclick="return doclink('link-220', 'msg', 'link-137');">msg</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">.</tt><tt id="link-221" class="py-name"><a title="p4vasp.message.MessageDriver.step
p4vasp.schedule'.Process.step" class="py-name" href="#" onclick="return doclink('link-221', 'step', 'link-218');">step</a></tt><tt class="py-op">(</tt><tt class="py-number">0</tt><tt class="py-op">,</tt><tt class="py-number">1</tt><tt class="py-op">)</tt> </tt>
<a name="L516"></a><tt class="py-lineno">516</tt>  <tt class="py-line">                <tt class="py-keyword">yield</tt> <tt class="py-number">1</tt> </tt>
<a name="L517"></a><tt class="py-lineno">517</tt>  <tt class="py-line"> </tt>
<a name="L518"></a><tt class="py-lineno">518</tt>  <tt class="py-line">            <tt class="py-name">dos</tt><tt class="py-op">=</tt><tt class="py-name">pm</tt><tt class="py-op">.</tt><tt class="py-name">PARTIAL_DOS_L</tt> </tt>
<a name="L519"></a><tt class="py-lineno">519</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">dos</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L520"></a><tt class="py-lineno">520</tt>  <tt class="py-line">                <tt id="link-222" class="py-name"><a title="p4vasp.msg" class="py-name" href="#" onclick="return doclink('link-222', 'msg', 'link-137');">msg</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">.</tt><tt id="link-223" class="py-name"><a title="p4vasp.message.MessageDriver.status
p4vasp.schedule'.Process.status" class="py-name" href="#" onclick="return doclink('link-223', 'status', 'link-171');">status</a></tt><tt class="py-op">(</tt><tt class="py-string">"Store local DOS"</tt><tt class="py-op">)</tt> </tt>
<a name="L521"></a><tt class="py-lineno">521</tt>  <tt class="py-line">                <tt class="py-keyword">yield</tt> <tt class="py-number">1</tt> </tt>
<a name="L522"></a><tt class="py-lineno">522</tt>  <tt class="py-line">                <tt class="py-keyword">if</tt> <tt id="link-224" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-224', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">dos</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">)</tt><tt class="py-op">==</tt><tt class="py-number">1</tt><tt class="py-op">:</tt> </tt>
<a name="L523"></a><tt class="py-lineno">523</tt>  <tt class="py-line">                    <tt class="py-name">spins</tt><tt class="py-op">=</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt> </tt>
<a name="L524"></a><tt class="py-lineno">524</tt>  <tt class="py-line">                <tt class="py-keyword">elif</tt> <tt id="link-225" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-225', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">dos</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">)</tt><tt class="py-op">==</tt><tt class="py-number">2</tt><tt class="py-op">:</tt> </tt>
<a name="L525"></a><tt class="py-lineno">525</tt>  <tt class="py-line">                    <tt class="py-name">spins</tt><tt class="py-op">=</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">,</tt><tt class="py-number">2</tt><tt class="py-op">]</tt> </tt>
<a name="L526"></a><tt class="py-lineno">526</tt>  <tt class="py-line">                <tt class="py-keyword">else</tt><tt class="py-op">:</tt> </tt>
<a name="L527"></a><tt class="py-lineno">527</tt>  <tt class="py-line">                    <tt class="py-name">spins</tt><tt class="py-op">=</tt><tt class="py-op">[</tt><tt class="py-op">-</tt><tt class="py-number">1</tt><tt class="py-op">,</tt><tt class="py-op">-</tt><tt class="py-number">2</tt><tt class="py-op">,</tt><tt class="py-op">-</tt><tt class="py-number">3</tt><tt class="py-op">,</tt><tt class="py-op">-</tt><tt class="py-number">4</tt><tt class="py-op">]</tt> </tt>
<a name="L528"></a><tt class="py-lineno">528</tt>  <tt class="py-line">                <tt class="py-name">progress</tt><tt class="py-op">=</tt><tt class="py-number">0</tt> </tt>
<a name="L529"></a><tt class="py-lineno">529</tt>  <tt class="py-line">                <tt id="link-226" class="py-name"><a title="p4vasp.schedule'.Process.total" class="py-name" href="#" onclick="return doclink('link-226', 'total', 'link-206');">total</a></tt><tt class="py-op">=</tt><tt id="link-227" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-227', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">dos</tt><tt class="py-op">)</tt><tt class="py-op">*</tt><tt id="link-228" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-228', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">dos</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">)</tt><tt class="py-op">*</tt><tt id="link-229" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-229', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">dos</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">)</tt> </tt>
<a name="L530"></a><tt class="py-lineno">530</tt>  <tt class="py-line">                <tt class="py-keyword">for</tt> <tt class="py-name">ion</tt> <tt class="py-keyword">in</tt> <tt class="py-name">xrange</tt><tt class="py-op">(</tt><tt id="link-230" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-230', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">dos</tt><tt class="py-op">)</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L531"></a><tt class="py-lineno">531</tt>  <tt class="py-line">                    <tt class="py-name">iond</tt><tt class="py-op">=</tt><tt class="py-name">dos</tt><tt class="py-op">[</tt><tt class="py-name">ion</tt><tt class="py-op">]</tt> </tt>
<a name="L532"></a><tt class="py-lineno">532</tt>  <tt class="py-line">                    <tt class="py-keyword">for</tt> <tt class="py-name">spin</tt> <tt class="py-keyword">in</tt> <tt class="py-name">xrange</tt><tt class="py-op">(</tt><tt id="link-231" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-231', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">iond</tt><tt class="py-op">)</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L533"></a><tt class="py-lineno">533</tt>  <tt class="py-line">                        <tt id="link-232" class="py-name"><a title="p4vasp.applet.STMWindowControlApplet.STMWindowControlApplet.sd" class="py-name" href="#" onclick="return doclink('link-232', 'sd', 'link-210');">sd</a></tt><tt class="py-op">=</tt><tt class="py-name">iond</tt><tt class="py-op">[</tt><tt class="py-name">spin</tt><tt class="py-op">]</tt> </tt>
<a name="L534"></a><tt class="py-lineno">534</tt>  <tt class="py-line"> </tt>
<a name="L535"></a><tt class="py-lineno">535</tt>  <tt class="py-line">                        <tt class="py-keyword">for</tt> <tt id="link-233" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-233', 'i', 'link-73');">i</a></tt> <tt class="py-keyword">in</tt> <tt class="py-name">xrange</tt><tt class="py-op">(</tt><tt id="link-234" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-234', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt id="link-235" class="py-name"><a title="p4vasp.applet.STMWindowControlApplet.STMWindowControlApplet.sd" class="py-name" href="#" onclick="return doclink('link-235', 'sd', 'link-210');">sd</a></tt><tt class="py-op">)</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L536"></a><tt class="py-lineno">536</tt>  <tt class="py-line">                            <tt class="py-name">sdi</tt><tt class="py-op">=</tt><tt id="link-236" class="py-name"><a title="p4vasp.applet.STMWindowControlApplet.STMWindowControlApplet.sd" class="py-name" href="#" onclick="return doclink('link-236', 'sd', 'link-210');">sd</a></tt><tt class="py-op">[</tt><tt id="link-237" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-237', 'i', 'link-73');">i</a></tt><tt class="py-op">]</tt> </tt>
<a name="L537"></a><tt class="py-lineno">537</tt>  <tt class="py-line">                            <tt class="py-name">energy</tt>     <tt class="py-op">=</tt><tt class="py-name">sdi</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt> </tt>
<a name="L538"></a><tt class="py-lineno">538</tt>  <tt class="py-line">                            <tt class="py-keyword">for</tt> <tt class="py-name">j</tt> <tt class="py-keyword">in</tt> <tt class="py-name">xrange</tt><tt class="py-op">(</tt><tt class="py-number">1</tt><tt class="py-op">,</tt><tt id="link-238" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-238', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">dos</tt><tt class="py-op">.</tt><tt class="py-name">field</tt><tt class="py-op">)</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L539"></a><tt class="py-lineno">539</tt>  <tt class="py-line">                                <tt class="py-name">density</tt>    <tt class="py-op">=</tt><tt class="py-name">sdi</tt><tt class="py-op">[</tt><tt class="py-name">j</tt><tt class="py-op">]</tt> </tt>
<a name="L540"></a><tt class="py-lineno">540</tt>  <tt class="py-line">                                <tt class="py-name">orbital</tt>    <tt class="py-op">=</tt><tt class="py-name">dos</tt><tt class="py-op">.</tt><tt class="py-name">field</tt><tt class="py-op">[</tt><tt class="py-name">j</tt><tt class="py-op">]</tt> </tt>
<a name="L541"></a><tt class="py-lineno">541</tt>  <tt class="py-line">                                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-239" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-239', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">'INSERT INTO #LDOS (calc_id,spin,energy,atomnumber,orbital,density)'</tt> </tt>
<a name="L542"></a><tt class="py-lineno">542</tt>  <tt class="py-line">                                <tt class="py-string">' VALUES (%d, %d, %f, %d, "%s", %f)'</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">calc_id</tt><tt class="py-op">,</tt><tt class="py-name">spins</tt><tt class="py-op">[</tt><tt class="py-name">spin</tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt class="py-name">energy</tt><tt class="py-op">,</tt><tt class="py-name">ion</tt><tt class="py-op">,</tt><tt class="py-name">orbital</tt><tt class="py-op">,</tt><tt class="py-name">density</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L543"></a><tt class="py-lineno">543</tt>  <tt class="py-line">                            <tt class="py-name">progress</tt><tt class="py-op">+=</tt><tt class="py-number">1</tt> </tt>
<a name="L544"></a><tt class="py-lineno">544</tt>  <tt class="py-line">                            <tt class="py-keyword">if</tt> <tt class="py-keyword">not</tt> <tt class="py-name">progress</tt><tt class="py-op">%</tt><tt class="py-number">10</tt><tt class="py-op">:</tt> </tt>
<a name="L545"></a><tt class="py-lineno">545</tt>  <tt class="py-line">                                <tt id="link-240" class="py-name"><a title="p4vasp.msg" class="py-name" href="#" onclick="return doclink('link-240', 'msg', 'link-137');">msg</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">.</tt><tt id="link-241" class="py-name"><a title="p4vasp.message.MessageDriver.step
p4vasp.schedule'.Process.step" class="py-name" href="#" onclick="return doclink('link-241', 'step', 'link-218');">step</a></tt><tt class="py-op">(</tt><tt class="py-name">progress</tt><tt class="py-op">,</tt><tt id="link-242" class="py-name"><a title="p4vasp.schedule'.Process.total" class="py-name" href="#" onclick="return doclink('link-242', 'total', 'link-206');">total</a></tt><tt class="py-op">)</tt> </tt>
<a name="L546"></a><tt class="py-lineno">546</tt>  <tt class="py-line">                                <tt class="py-keyword">yield</tt> <tt class="py-number">1</tt> </tt>
<a name="L547"></a><tt class="py-lineno">547</tt>  <tt class="py-line">                <tt id="link-243" class="py-name"><a title="p4vasp.msg" class="py-name" href="#" onclick="return doclink('link-243', 'msg', 'link-137');">msg</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">.</tt><tt id="link-244" class="py-name"><a title="p4vasp.message.MessageDriver.step
p4vasp.schedule'.Process.step" class="py-name" href="#" onclick="return doclink('link-244', 'step', 'link-218');">step</a></tt><tt class="py-op">(</tt><tt class="py-number">0</tt><tt class="py-op">,</tt><tt class="py-number">1</tt><tt class="py-op">)</tt> </tt>
<a name="L548"></a><tt class="py-lineno">548</tt>  <tt class="py-line">                <tt class="py-keyword">yield</tt> <tt class="py-number">1</tt> </tt>
<a name="L549"></a><tt class="py-lineno">549</tt>  <tt class="py-line"> </tt>
<a name="L550"></a><tt class="py-lineno">550</tt>  <tt class="py-line">            <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">pm</tt><tt class="py-op">.</tt><tt class="py-name">INITIAL_STRUCTURE</tt> </tt>
<a name="L551"></a><tt class="py-lineno">551</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">s</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L552"></a><tt class="py-lineno">552</tt>  <tt class="py-line">                <tt id="link-245" class="py-name"><a title="p4vasp.msg" class="py-name" href="#" onclick="return doclink('link-245', 'msg', 'link-137');">msg</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">.</tt><tt id="link-246" class="py-name"><a title="p4vasp.message.MessageDriver.status
p4vasp.schedule'.Process.status" class="py-name" href="#" onclick="return doclink('link-246', 'status', 'link-171');">status</a></tt><tt class="py-op">(</tt><tt class="py-string">"Store initial structure."</tt><tt class="py-op">)</tt> </tt>
<a name="L553"></a><tt class="py-lineno">553</tt>  <tt class="py-line">                <tt class="py-keyword">yield</tt> <tt class="py-number">1</tt> </tt>
<a name="L554"></a><tt class="py-lineno">554</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-247" class="py-name" targets="Method p4vasp.db.P4VMixin.storeStructure()=p4vasp.db.P4VMixin-class.html#storeStructure"><a title="p4vasp.db.P4VMixin.storeStructure" class="py-name" href="#" onclick="return doclink('link-247', 'storeStructure', 'link-247');">storeStructure</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">,</tt><tt class="py-op">-</tt><tt class="py-number">1</tt><tt class="py-op">)</tt> </tt>
<a name="L555"></a><tt class="py-lineno">555</tt>  <tt class="py-line"> </tt>
<a name="L556"></a><tt class="py-lineno">556</tt>  <tt class="py-line">            <tt class="py-name">s</tt><tt class="py-op">=</tt><tt class="py-name">pm</tt><tt class="py-op">.</tt><tt class="py-name">FINAL_STRUCTURE</tt> </tt>
<a name="L557"></a><tt class="py-lineno">557</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">s</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L558"></a><tt class="py-lineno">558</tt>  <tt class="py-line">                <tt id="link-248" class="py-name"><a title="p4vasp.msg" class="py-name" href="#" onclick="return doclink('link-248', 'msg', 'link-137');">msg</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">.</tt><tt id="link-249" class="py-name"><a title="p4vasp.message.MessageDriver.status
p4vasp.schedule'.Process.status" class="py-name" href="#" onclick="return doclink('link-249', 'status', 'link-171');">status</a></tt><tt class="py-op">(</tt><tt class="py-string">"Store final structure."</tt><tt class="py-op">)</tt> </tt>
<a name="L559"></a><tt class="py-lineno">559</tt>  <tt class="py-line">                <tt class="py-keyword">yield</tt> <tt class="py-number">1</tt> </tt>
<a name="L560"></a><tt class="py-lineno">560</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-250" class="py-name"><a title="p4vasp.db.P4VMixin.storeStructure" class="py-name" href="#" onclick="return doclink('link-250', 'storeStructure', 'link-247');">storeStructure</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">,</tt><tt class="py-op">-</tt><tt class="py-number">2</tt><tt class="py-op">)</tt> </tt>
<a name="L561"></a><tt class="py-lineno">561</tt>  <tt class="py-line"> </tt>
<a name="L562"></a><tt class="py-lineno">562</tt>  <tt class="py-line">            <tt class="py-name">seq</tt>  <tt class="py-op">=</tt><tt class="py-name">pm</tt><tt class="py-op">.</tt><tt class="py-name">STRUCTURE_SEQUENCE_L</tt> </tt>
<a name="L563"></a><tt class="py-lineno">563</tt>  <tt class="py-line">            <tt class="py-name">fseq</tt> <tt class="py-op">=</tt><tt class="py-name">pm</tt><tt class="py-op">.</tt><tt class="py-name">FORCES_SEQUENCE_L</tt> </tt>
<a name="L564"></a><tt class="py-lineno">564</tt>  <tt class="py-line"> </tt>
<a name="L565"></a><tt class="py-lineno">565</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">seq</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L566"></a><tt class="py-lineno">566</tt>  <tt class="py-line">                <tt id="link-251" class="py-name"><a title="p4vasp.msg" class="py-name" href="#" onclick="return doclink('link-251', 'msg', 'link-137');">msg</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">.</tt><tt id="link-252" class="py-name"><a title="p4vasp.message.MessageDriver.status
p4vasp.schedule'.Process.status" class="py-name" href="#" onclick="return doclink('link-252', 'status', 'link-171');">status</a></tt><tt class="py-op">(</tt><tt class="py-string">"Store structure sequence."</tt><tt class="py-op">)</tt> </tt>
<a name="L567"></a><tt class="py-lineno">567</tt>  <tt class="py-line">                <tt class="py-keyword">yield</tt> <tt class="py-number">1</tt> </tt>
<a name="L568"></a><tt class="py-lineno">568</tt>  <tt class="py-line">                <tt class="py-keyword">for</tt> <tt id="link-253" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-253', 'i', 'link-73');">i</a></tt> <tt class="py-keyword">in</tt> <tt class="py-name">range</tt><tt class="py-op">(</tt><tt id="link-254" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-254', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">seq</tt><tt class="py-op">)</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L569"></a><tt class="py-lineno">569</tt>  <tt class="py-line">                    <tt id="link-255" class="py-name"><a title="p4vasp.msg" class="py-name" href="#" onclick="return doclink('link-255', 'msg', 'link-137');">msg</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">.</tt><tt id="link-256" class="py-name"><a title="p4vasp.message.MessageDriver.step
p4vasp.schedule'.Process.step" class="py-name" href="#" onclick="return doclink('link-256', 'step', 'link-218');">step</a></tt><tt class="py-op">(</tt><tt id="link-257" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-257', 'i', 'link-73');">i</a></tt><tt class="py-op">,</tt><tt id="link-258" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-258', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">seq</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L570"></a><tt class="py-lineno">570</tt>  <tt class="py-line">                    <tt class="py-keyword">yield</tt> <tt class="py-number">1</tt> </tt>
<a name="L571"></a><tt class="py-lineno">571</tt>  <tt class="py-line">                    <tt class="py-name">sid</tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-259" class="py-name"><a title="p4vasp.db.P4VMixin.storeStructure" class="py-name" href="#" onclick="return doclink('link-259', 'storeStructure', 'link-247');">storeStructure</a></tt><tt class="py-op">(</tt><tt class="py-name">seq</tt><tt class="py-op">[</tt><tt id="link-260" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-260', 'i', 'link-73');">i</a></tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt id="link-261" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-261', 'i', 'link-73');">i</a></tt><tt class="py-op">)</tt> </tt>
<a name="L572"></a><tt class="py-lineno">572</tt>  <tt class="py-line">                    <tt class="py-keyword">if</tt> <tt class="py-name">fseq</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L573"></a><tt class="py-lineno">573</tt>  <tt class="py-line">                        <tt class="py-name">f</tt><tt class="py-op">=</tt><tt class="py-name">fseq</tt><tt class="py-op">[</tt><tt id="link-262" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-262', 'i', 'link-73');">i</a></tt><tt class="py-op">]</tt> </tt>
<a name="L574"></a><tt class="py-lineno">574</tt>  <tt class="py-line">                        <tt class="py-keyword">if</tt> <tt class="py-name">f</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L575"></a><tt class="py-lineno">575</tt>  <tt class="py-line">                            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-263" class="py-name" targets="Method p4vasp.db.P4VMixin.storeForce()=p4vasp.db.P4VMixin-class.html#storeForce"><a title="p4vasp.db.P4VMixin.storeForce" class="py-name" href="#" onclick="return doclink('link-263', 'storeForce', 'link-263');">storeForce</a></tt><tt class="py-op">(</tt><tt class="py-name">f</tt><tt class="py-op">,</tt><tt class="py-name">sid</tt><tt class="py-op">)</tt> </tt>
<a name="L576"></a><tt class="py-lineno">576</tt>  <tt class="py-line">                <tt id="link-264" class="py-name"><a title="p4vasp.msg" class="py-name" href="#" onclick="return doclink('link-264', 'msg', 'link-137');">msg</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">.</tt><tt id="link-265" class="py-name"><a title="p4vasp.message.MessageDriver.step
p4vasp.schedule'.Process.step" class="py-name" href="#" onclick="return doclink('link-265', 'step', 'link-218');">step</a></tt><tt class="py-op">(</tt><tt class="py-number">0</tt><tt class="py-op">,</tt><tt class="py-number">1</tt><tt class="py-op">)</tt> </tt>
<a name="L577"></a><tt class="py-lineno">577</tt>  <tt class="py-line">                <tt class="py-keyword">yield</tt> <tt class="py-number">1</tt> </tt>
<a name="L578"></a><tt class="py-lineno">578</tt>  <tt class="py-line"> </tt>
<a name="L579"></a><tt class="py-lineno">579</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-266" class="py-name"><a title="p4vasp.db.DBI.commit
p4vasp.db.DBIContainer.commit
p4vasp.db.MySQLDBI.commit" class="py-name" href="#" onclick="return doclink('link-266', 'commit', 'link-67');">commit</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L580"></a><tt class="py-lineno">580</tt>  <tt class="py-line"> </tt>
<a name="L581"></a><tt class="py-lineno">581</tt>  <tt class="py-line">            <tt id="link-267" class="py-name"><a title="p4vasp.msg" class="py-name" href="#" onclick="return doclink('link-267', 'msg', 'link-137');">msg</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">.</tt><tt id="link-268" class="py-name"><a title="p4vasp.message.MessageDriver.status
p4vasp.schedule'.Process.status" class="py-name" href="#" onclick="return doclink('link-268', 'status', 'link-171');">status</a></tt><tt class="py-op">(</tt><tt class="py-string">"OK"</tt><tt class="py-op">)</tt> </tt>
<a name="L582"></a><tt class="py-lineno">582</tt>  <tt class="py-line">            <tt id="link-269" class="py-name"><a title="p4vasp.msg" class="py-name" href="#" onclick="return doclink('link-269', 'msg', 'link-137');">msg</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">.</tt><tt id="link-270" class="py-name"><a title="p4vasp.message.MessageDriver.step
p4vasp.schedule'.Process.step" class="py-name" href="#" onclick="return doclink('link-270', 'step', 'link-218');">step</a></tt><tt class="py-op">(</tt><tt class="py-number">0</tt><tt class="py-op">,</tt><tt class="py-number">1</tt><tt class="py-op">)</tt> </tt>
<a name="L583"></a><tt class="py-lineno">583</tt>  <tt class="py-line">            <tt class="py-keyword">yield</tt> <tt class="py-number">1</tt> </tt>
<a name="L584"></a><tt class="py-lineno">584</tt>  <tt class="py-line">        <tt class="py-keyword">except</tt><tt class="py-op">:</tt> </tt>
<a name="L585"></a><tt class="py-lineno">585</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">calc_id</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L586"></a><tt class="py-lineno">586</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-271" class="py-name" targets="Method p4vasp.db.P4VMixin.removeCalculation()=p4vasp.db.P4VMixin-class.html#removeCalculation"><a title="p4vasp.db.P4VMixin.removeCalculation" class="py-name" href="#" onclick="return doclink('link-271', 'removeCalculation', 'link-271');">removeCalculation</a></tt><tt class="py-op">(</tt><tt class="py-name">calc_id</tt><tt class="py-op">)</tt> </tt>
<a name="L587"></a><tt class="py-lineno">587</tt>  <tt class="py-line">            <tt class="py-keyword">raise</tt> </tt>
</div><a name="L588"></a><tt class="py-lineno">588</tt>  <tt class="py-line"> </tt>
<a name="P4VMixin.removeStructure"></a><div id="P4VMixin.removeStructure-def"><a name="L589"></a><tt class="py-lineno">589</tt> <a class="py-toggle" href="#" id="P4VMixin.removeStructure-toggle" onclick="return toggle('P4VMixin.removeStructure');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.P4VMixin-class.html#removeStructure">removeStructure</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">i</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="P4VMixin.removeStructure-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="P4VMixin.removeStructure-expanded"><a name="L590"></a><tt class="py-lineno">590</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt id="link-272" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-272', 'i', 'link-73');">i</a></tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L591"></a><tt class="py-lineno">591</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-273" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-273', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">"DELETE FROM #STRUCT WHERE id=%d"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt id="link-274" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-274', 'i', 'link-73');">i</a></tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L592"></a><tt class="py-lineno">592</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-275" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-275', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">"DELETE FROM #STRUCTPOS WHERE structure_id=%d"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt id="link-276" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-276', 'i', 'link-73');">i</a></tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L593"></a><tt class="py-lineno">593</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-277" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-277', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">"DELETE FROM #STRUCTFORCE WHERE structure_id=%d"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt id="link-278" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-278', 'i', 'link-73');">i</a></tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L594"></a><tt class="py-lineno">594</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-279" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-279', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">"DELETE FROM #STRUCTVELOCITY WHERE structure_id=%d"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt id="link-280" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-280', 'i', 'link-73');">i</a></tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L595"></a><tt class="py-lineno">595</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-281" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-281', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">"DELETE FROM #STRUCTCONSTRAINTS WHERE structure_id=%d"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt id="link-282" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-282', 'i', 'link-73');">i</a></tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L596"></a><tt class="py-lineno">596</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-283" class="py-name"><a title="p4vasp.db.DBI.commit
p4vasp.db.DBIContainer.commit
p4vasp.db.MySQLDBI.commit" class="py-name" href="#" onclick="return doclink('link-283', 'commit', 'link-67');">commit</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
</div><a name="L597"></a><tt class="py-lineno">597</tt>  <tt class="py-line"> </tt>
<a name="P4VMixin.removeCalculation"></a><div id="P4VMixin.removeCalculation-def"><a name="L598"></a><tt class="py-lineno">598</tt> <a class="py-toggle" href="#" id="P4VMixin.removeCalculation-toggle" onclick="return toggle('P4VMixin.removeCalculation');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.P4VMixin-class.html#removeCalculation">removeCalculation</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">i</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="P4VMixin.removeCalculation-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="P4VMixin.removeCalculation-expanded"><a name="L599"></a><tt class="py-lineno">599</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt id="link-284" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-284', 'i', 'link-73');">i</a></tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L600"></a><tt class="py-lineno">600</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-285" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-285', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">"DELETE FROM #CALC WHERE id=%d"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt id="link-286" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-286', 'i', 'link-73');">i</a></tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L601"></a><tt class="py-lineno">601</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-287" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-287', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">"DELETE FROM #PARAMETERS WHERE calc_id=%d"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt id="link-288" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-288', 'i', 'link-73');">i</a></tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L602"></a><tt class="py-lineno">602</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-289" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-289', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">"DELETE FROM #STRUCTPOS WHERE calc_id=%d"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt id="link-290" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-290', 'i', 'link-73');">i</a></tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L603"></a><tt class="py-lineno">603</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-291" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-291', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">"DELETE FROM #STRUCTFORCE WHERE calc_id=%d"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt id="link-292" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-292', 'i', 'link-73');">i</a></tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L604"></a><tt class="py-lineno">604</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-293" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-293', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">"DELETE FROM #STRUCTVELOCITY WHERE calc_id=%d"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt id="link-294" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-294', 'i', 'link-73');">i</a></tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L605"></a><tt class="py-lineno">605</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-295" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-295', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">"DELETE FROM #STRUCTCONSTRAINTS WHERE calc_id=%d"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt id="link-296" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-296', 'i', 'link-73');">i</a></tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L606"></a><tt class="py-lineno">606</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-297" class="py-name"><a title="p4vasp.db.DBI.commit
p4vasp.db.DBIContainer.commit
p4vasp.db.MySQLDBI.commit" class="py-name" href="#" onclick="return doclink('link-297', 'commit', 'link-67');">commit</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
</div><a name="L607"></a><tt class="py-lineno">607</tt>  <tt class="py-line"> </tt>
<a name="P4VMixin.storeStructure"></a><div id="P4VMixin.storeStructure-def"><a name="L608"></a><tt class="py-lineno">608</tt> <a class="py-toggle" href="#" id="P4VMixin.storeStructure-toggle" onclick="return toggle('P4VMixin.storeStructure');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.P4VMixin-class.html#storeStructure">storeStructure</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">s</tt><tt class="py-op">,</tt><tt class="py-param">step</tt><tt class="py-op">=</tt><tt class="py-name">None</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="P4VMixin.storeStructure-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="P4VMixin.storeStructure-expanded"><a name="L609"></a><tt class="py-lineno">609</tt>  <tt class="py-line">        <tt class="py-name">calc_id</tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">calc_id</tt> </tt>
<a name="L610"></a><tt class="py-lineno">610</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt class="py-name">calc_id</tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt> <tt class="py-keyword">and</tt> <tt id="link-298" class="py-name"><a title="p4vasp.message.MessageDriver.step
p4vasp.schedule'.Process.step" class="py-name" href="#" onclick="return doclink('link-298', 'step', 'link-218');">step</a></tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt><tt class="py-op">:</tt> </tt>
<a name="L611"></a><tt class="py-lineno">611</tt>  <tt class="py-line">            <tt class="py-keyword">for</tt> <tt class="py-name">l</tt> <tt class="py-keyword">in</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-299" class="py-name"><a title="p4vasp.db.DBI.fetchall" class="py-name" href="#" onclick="return doclink('link-299', 'fetchall', 'link-43');">fetchall</a></tt><tt class="py-op">(</tt><tt class="py-string">"SELECT id FROM #STRUCT WHERE calc_id=%d AND step=%d"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">calc_id</tt><tt class="py-op">,</tt><tt id="link-300" class="py-name"><a title="p4vasp.message.MessageDriver.step
p4vasp.schedule'.Process.step" class="py-name" href="#" onclick="return doclink('link-300', 'step', 'link-218');">step</a></tt><tt class="py-op">)</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L612"></a><tt class="py-lineno">612</tt>  <tt class="py-line">                <tt id="link-301" class="py-name" targets="Method p4vasp.db.P4VMixin.removeStructure()=p4vasp.db.P4VMixin-class.html#removeStructure"><a title="p4vasp.db.P4VMixin.removeStructure" class="py-name" href="#" onclick="return doclink('link-301', 'removeStructure', 'link-301');">removeStructure</a></tt><tt class="py-op">(</tt><tt id="link-302" class="py-name"><a title="p4vasp.db" class="py-name" href="#" onclick="return doclink('link-302', 'db', 'link-10');">db</a></tt><tt class="py-op">,</tt><tt class="py-name">l</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">)</tt> </tt>
<a name="L613"></a><tt class="py-lineno">613</tt>  <tt class="py-line"> </tt>
<a name="L614"></a><tt class="py-lineno">614</tt>  <tt class="py-line">        <tt class="py-name">info</tt><tt class="py-op">=</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">info</tt> </tt>
<a name="L615"></a><tt class="py-lineno">615</tt>  <tt class="py-line"> </tt>
<a name="L616"></a><tt class="py-lineno">616</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt id="link-303" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-303', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">scaling</tt><tt class="py-op">)</tt><tt class="py-op">!=</tt><tt class="py-number">1</tt><tt class="py-op">:</tt> </tt>
<a name="L617"></a><tt class="py-lineno">617</tt>  <tt class="py-line">            <tt class="py-name">s</tt><tt class="py-op">.</tt><tt id="link-304" class="py-name" targets="Method p4vasp.Structure.Structure.correctScaling()=p4vasp.Structure.Structure-class.html#correctScaling,Method p4vasp.cStructure.Structure.correctScaling()=p4vasp.cStructure.Structure-class.html#correctScaling"><a title="p4vasp.Structure.Structure.correctScaling
p4vasp.cStructure.Structure.correctScaling" class="py-name" href="#" onclick="return doclink('link-304', 'correctScaling', 'link-304');">correctScaling</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L618"></a><tt class="py-lineno">618</tt>  <tt class="py-line"> </tt>
<a name="L619"></a><tt class="py-lineno">619</tt>  <tt class="py-line">        <tt class="py-name">cmd</tt> <tt class="py-op">=</tt><tt class="py-string">"%s, %s,"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt id="link-305" class="py-name" targets="Function p4vasp.db.von()=p4vasp.db-module.html#von"><a title="p4vasp.db.von" class="py-name" href="#" onclick="return doclink('link-305', 'von', 'link-305');">von</a></tt><tt class="py-op">(</tt><tt class="py-name">calc_id</tt><tt class="py-op">)</tt><tt class="py-op">,</tt> <tt id="link-306" class="py-name"><a title="p4vasp.db.von" class="py-name" href="#" onclick="return doclink('link-306', 'von', 'link-305');">von</a></tt><tt class="py-op">(</tt><tt id="link-307" class="py-name"><a title="p4vasp.message.MessageDriver.step
p4vasp.schedule'.Process.step" class="py-name" href="#" onclick="return doclink('link-307', 'step', 'link-218');">step</a></tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L620"></a><tt class="py-lineno">620</tt>  <tt class="py-line">        <tt class="py-name">cmd</tt><tt class="py-op">+=</tt><tt class="py-string">"%14.12f,'%s',"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt>    <tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">scaling</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">comment</tt><tt class="py-op">)</tt> </tt>
<a name="L621"></a><tt class="py-lineno">621</tt>  <tt class="py-line">        <tt class="py-name">cmd</tt><tt class="py-op">+=</tt><tt class="py-string">"""%14.12f,%14.12f,%14.12f,</tt> </tt>
<a name="L622"></a><tt class="py-lineno">622</tt>  <tt class="py-line"><tt class="py-string">        %14.12f,%14.12f,%14.12f,</tt> </tt>
<a name="L623"></a><tt class="py-lineno">623</tt>  <tt class="py-line"><tt class="py-string">        %14.12f,%14.12f,%14.12f,%d"""</tt><tt class="py-op">%</tt><tt class="py-op">(</tt> </tt>
<a name="L624"></a><tt class="py-lineno">624</tt>  <tt class="py-line">        <tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">basis</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">basis</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">basis</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">2</tt><tt class="py-op">]</tt><tt class="py-op">,</tt> </tt>
<a name="L625"></a><tt class="py-lineno">625</tt>  <tt class="py-line">        <tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">basis</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">basis</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">basis</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">2</tt><tt class="py-op">]</tt><tt class="py-op">,</tt> </tt>
<a name="L626"></a><tt class="py-lineno">626</tt>  <tt class="py-line">        <tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">basis</tt><tt class="py-op">[</tt><tt class="py-number">2</tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">basis</tt><tt class="py-op">[</tt><tt class="py-number">2</tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">basis</tt><tt class="py-op">[</tt><tt class="py-number">2</tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">2</tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">types</tt><tt class="py-op">)</tt> </tt>
<a name="L627"></a><tt class="py-lineno">627</tt>  <tt class="py-line"> </tt>
<a name="L628"></a><tt class="py-lineno">628</tt>  <tt class="py-line">        <tt class="py-name">Id</tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-308" class="py-name"><a title="p4vasp.db.DBI.insertRecord" class="py-name" href="#" onclick="return doclink('link-308', 'insertRecord', 'link-161');">insertRecord</a></tt><tt class="py-op">(</tt><tt class="py-string">"#STRUCT"</tt><tt class="py-op">,</tt><tt class="py-string">"id"</tt><tt class="py-op">,</tt><tt class="py-string">"calc_id, step, scale,comment,a11,a12,a13,a21,a22,a23,a31,a32,a33,species"</tt><tt class="py-op">,</tt><tt class="py-name">cmd</tt><tt class="py-op">)</tt> </tt>
<a name="L629"></a><tt class="py-lineno">629</tt>  <tt class="py-line"> </tt>
<a name="L630"></a><tt class="py-lineno">630</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt class="py-name">s</tt><tt class="py-op">.</tt><tt id="link-309" class="py-name" targets="Method p4vasp.Structure.Structure.isSelective()=p4vasp.Structure.Structure-class.html#isSelective,Method p4vasp.cStructure.Structure.isSelective()=p4vasp.cStructure.Structure-class.html#isSelective"><a title="p4vasp.Structure.Structure.isSelective
p4vasp.cStructure.Structure.isSelective" class="py-name" href="#" onclick="return doclink('link-309', 'isSelective', 'link-309');">isSelective</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L631"></a><tt class="py-lineno">631</tt>  <tt class="py-line">            <tt class="py-name">sel</tt>    <tt class="py-op">=</tt> <tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">selective</tt> </tt>
<a name="L632"></a><tt class="py-lineno">632</tt>  <tt class="py-line">            <tt class="py-keyword">for</tt> <tt id="link-310" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-310', 'i', 'link-73');">i</a></tt> <tt class="py-keyword">in</tt> <tt class="py-name">range</tt><tt class="py-op">(</tt><tt id="link-311" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-311', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">sel</tt><tt class="py-op">)</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L633"></a><tt class="py-lineno">633</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-312" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-312', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">"""INSERT INTO #STRUCTCONSTRAINTS (structure_id,calc_id,atomnumber,x,y,z)</tt> </tt>
<a name="L634"></a><tt class="py-lineno">634</tt>  <tt class="py-line"><tt class="py-string">                VALUES (%d,%s,%d,%d,%d,%d)"""</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">Id</tt><tt class="py-op">,</tt><tt id="link-313" class="py-name"><a title="p4vasp.db.von" class="py-name" href="#" onclick="return doclink('link-313', 'von', 'link-305');">von</a></tt><tt class="py-op">(</tt><tt class="py-name">calc_id</tt><tt class="py-op">)</tt><tt class="py-op">,</tt><tt id="link-314" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-314', 'i', 'link-73');">i</a></tt><tt class="py-op">,</tt><tt class="py-name">sel</tt><tt class="py-op">[</tt><tt id="link-315" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-315', 'i', 'link-73');">i</a></tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt class="py-name">sel</tt><tt class="py-op">[</tt><tt id="link-316" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-316', 'i', 'link-73');">i</a></tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt class="py-name">sel</tt><tt class="py-op">[</tt><tt id="link-317" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-317', 'i', 'link-73');">i</a></tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">2</tt><tt class="py-op">]</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L635"></a><tt class="py-lineno">635</tt>  <tt class="py-line"> </tt>
<a name="L636"></a><tt class="py-lineno">636</tt>  <tt class="py-line"> </tt>
<a name="L637"></a><tt class="py-lineno">637</tt>  <tt class="py-line">        <tt class="py-name">sc</tt><tt class="py-op">=</tt><tt id="link-318" class="py-name"><a title="p4vasp.Structure
p4vasp.Structure.Structure
p4vasp.cStructure.Structure" class="py-name" href="#" onclick="return doclink('link-318', 'Structure', 'link-3');">Structure</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L638"></a><tt class="py-lineno">638</tt>  <tt class="py-line">        <tt class="py-name">sc</tt><tt class="py-op">.</tt><tt id="link-319" class="py-name" targets="Method p4vasp.Structure.Structure.setStructure()=p4vasp.Structure.Structure-class.html#setStructure,Method p4vasp.StructureWindow.StructureWindow.setStructure()=p4vasp.StructureWindow.StructureWindow-class.html#setStructure,Method p4vasp.applet.BuilderApplet.StructureTreeModel.setStructure()=p4vasp.applet.BuilderApplet.StructureTreeModel-class.html#setStructure,Method p4vasp.applet.STMWindowApplet.STMWindowApplet.setStructure()=p4vasp.applet.STMWindowApplet.STMWindowApplet-class.html#setStructure,Method p4vasp.applet.StructureApplet.StructureApplet.setStructure()=p4vasp.applet.StructureApplet.StructureApplet-class.html#setStructure,Method p4vasp.applet.StructureWindowApplet.StructureWindowApplet.setStructure()=p4vasp.applet.StructureWindowApplet.StructureWindowApplet-class.html#setStructure,Method p4vasp.cStructure.Structure.setStructure()=p4vasp.cStructure.Structure-class.html#setStructure"><a title="p4vasp.Structure.Structure.setStructure
p4vasp.StructureWindow.StructureWindow.setStructure
p4vasp.applet.BuilderApplet.StructureTreeModel.setStructure
p4vasp.applet.STMWindowApplet.STMWindowApplet.setStructure
p4vasp.applet.StructureApplet.StructureApplet.setStructure
p4vasp.applet.StructureWindowApplet.StructureWindowApplet.setStructure
p4vasp.cStructure.Structure.setStructure" class="py-name" href="#" onclick="return doclink('link-319', 'setStructure', 'link-319');">setStructure</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt> </tt>
<a name="L639"></a><tt class="py-lineno">639</tt>  <tt class="py-line">        <tt class="py-name">sc</tt><tt class="py-op">.</tt><tt id="link-320" class="py-name" targets="Method p4vasp.Structure.Structure.setCartesian()=p4vasp.Structure.Structure-class.html#setCartesian"><a title="p4vasp.Structure.Structure.setCartesian" class="py-name" href="#" onclick="return doclink('link-320', 'setCartesian', 'link-320');">setCartesian</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L640"></a><tt class="py-lineno">640</tt>  <tt class="py-line"> </tt>
<a name="L641"></a><tt class="py-lineno">641</tt>  <tt class="py-line"> </tt>
<a name="L642"></a><tt class="py-lineno">642</tt>  <tt class="py-line">        <tt class="py-keyword">for</tt> <tt id="link-321" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-321', 'i', 'link-73');">i</a></tt> <tt class="py-keyword">in</tt> <tt class="py-name">range</tt><tt class="py-op">(</tt><tt id="link-322" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-322', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L643"></a><tt class="py-lineno">643</tt>  <tt class="py-line">            <tt class="py-name">si</tt><tt class="py-op">=</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt id="link-323" class="py-name" targets="Method p4vasp.Structure.AtomInfo.speciesIndex()=p4vasp.Structure.AtomInfo-class.html#speciesIndex,Method p4vasp.Structure.Structure.speciesIndex()=p4vasp.Structure.Structure-class.html#speciesIndex"><a title="p4vasp.Structure.AtomInfo.speciesIndex
p4vasp.Structure.Structure.speciesIndex" class="py-name" href="#" onclick="return doclink('link-323', 'speciesIndex', 'link-323');">speciesIndex</a></tt><tt class="py-op">(</tt><tt id="link-324" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-324', 'i', 'link-73');">i</a></tt><tt class="py-op">)</tt> </tt>
<a name="L644"></a><tt class="py-lineno">644</tt>  <tt class="py-line"> </tt>
<a name="L645"></a><tt class="py-lineno">645</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-325" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-325', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">"""INSERT INTO #STRUCTPOS (structure_id,calc_id,atomnumber,specie,element,x,y,z)</tt> </tt>
<a name="L646"></a><tt class="py-lineno">646</tt>  <tt class="py-line"><tt class="py-string">            VALUES (%d,%s,%d,%d,'%s',%14.12f,%14.12f,%14.12f)"""</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">Id</tt><tt class="py-op">,</tt><tt id="link-326" class="py-name"><a title="p4vasp.db.von" class="py-name" href="#" onclick="return doclink('link-326', 'von', 'link-305');">von</a></tt><tt class="py-op">(</tt><tt class="py-name">calc_id</tt><tt class="py-op">)</tt><tt class="py-op">,</tt><tt id="link-327" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-327', 'i', 'link-73');">i</a></tt><tt class="py-op">,</tt><tt class="py-name">si</tt><tt class="py-op">,</tt><tt class="py-name">info</tt><tt class="py-op">[</tt><tt class="py-name">si</tt><tt class="py-op">]</tt><tt class="py-op">.</tt><tt id="link-328" class="py-name" targets="Variable p4vasp.cStructure.AtomInfo.element=p4vasp.cStructure.AtomInfo-class.html#element"><a title="p4vasp.cStructure.AtomInfo.element" class="py-name" href="#" onclick="return doclink('link-328', 'element', 'link-328');">element</a></tt><tt class="py-op">,</tt> </tt>
<a name="L647"></a><tt class="py-lineno">647</tt>  <tt class="py-line">            <tt class="py-name">sc</tt><tt class="py-op">[</tt><tt id="link-329" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-329', 'i', 'link-73');">i</a></tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">,</tt>            <tt class="py-name">sc</tt><tt class="py-op">[</tt><tt id="link-330" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-330', 'i', 'link-73');">i</a></tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">]</tt><tt class="py-op">,</tt>            <tt class="py-name">sc</tt><tt class="py-op">[</tt><tt id="link-331" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-331', 'i', 'link-73');">i</a></tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">2</tt><tt class="py-op">]</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L648"></a><tt class="py-lineno">648</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-332" class="py-name"><a title="p4vasp.db.DBI.commit
p4vasp.db.DBIContainer.commit
p4vasp.db.MySQLDBI.commit" class="py-name" href="#" onclick="return doclink('link-332', 'commit', 'link-67');">commit</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L649"></a><tt class="py-lineno">649</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-name">Id</tt> </tt>
</div><a name="L650"></a><tt class="py-lineno">650</tt>  <tt class="py-line"> </tt>
<a name="L651"></a><tt class="py-lineno">651</tt>  <tt class="py-line"> </tt>
<a name="P4VMixin.readStructure"></a><div id="P4VMixin.readStructure-def"><a name="L652"></a><tt class="py-lineno">652</tt> <a class="py-toggle" href="#" id="P4VMixin.readStructure-toggle" onclick="return toggle('P4VMixin.readStructure');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.P4VMixin-class.html#readStructure">readStructure</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">Id</tt><tt class="py-op">,</tt><tt class="py-param">cstructure</tt><tt class="py-op">=</tt><tt class="py-name">False</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="P4VMixin.readStructure-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="P4VMixin.readStructure-expanded"><a name="L653"></a><tt class="py-lineno">653</tt>  <tt class="py-line">        <tt class="py-name">s</tt><tt class="py-op">=</tt><tt id="link-333" class="py-name"><a title="p4vasp.Structure
p4vasp.Structure.Structure
p4vasp.cStructure.Structure" class="py-name" href="#" onclick="return doclink('link-333', 'Structure', 'link-3');">Structure</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L654"></a><tt class="py-lineno">654</tt>  <tt class="py-line">        <tt class="py-name">l</tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-334" class="py-name"><a title="p4vasp.db.DBI.fetchone
p4vasp.db.DBIContainer.fetchone" class="py-name" href="#" onclick="return doclink('link-334', 'fetchone', 'link-49');">fetchone</a></tt><tt class="py-op">(</tt><tt class="py-string">"""SELECT calc_id,scale,comment,a11,a12,a13,a21,a22,a23,a31,a32,a33,</tt> </tt>
<a name="L655"></a><tt class="py-lineno">655</tt>  <tt class="py-line"><tt class="py-string">          species FROM #STRUCT WHERE id=%d"""</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">Id</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L656"></a><tt class="py-lineno">656</tt>  <tt class="py-line">        <tt class="py-op">(</tt><tt class="py-name">calc_id</tt><tt class="py-op">,</tt><tt id="link-335" class="py-name" targets="Method p4vasp.Structure.Structure.scale()=p4vasp.Structure.Structure-class.html#scale"><a title="p4vasp.Structure.Structure.scale" class="py-name" href="#" onclick="return doclink('link-335', 'scale', 'link-335');">scale</a></tt> <tt class="py-op">,</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">comment</tt><tt class="py-op">,</tt> </tt>
<a name="L657"></a><tt class="py-lineno">657</tt>  <tt class="py-line">         <tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">basis</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">basis</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">basis</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">2</tt><tt class="py-op">]</tt><tt class="py-op">,</tt> </tt>
<a name="L658"></a><tt class="py-lineno">658</tt>  <tt class="py-line">         <tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">basis</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">basis</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">basis</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">2</tt><tt class="py-op">]</tt><tt class="py-op">,</tt> </tt>
<a name="L659"></a><tt class="py-lineno">659</tt>  <tt class="py-line">         <tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">basis</tt><tt class="py-op">[</tt><tt class="py-number">2</tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">basis</tt><tt class="py-op">[</tt><tt class="py-number">2</tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">basis</tt><tt class="py-op">[</tt><tt class="py-number">2</tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">2</tt><tt class="py-op">]</tt><tt class="py-op">,</tt><tt class="py-name">spec</tt><tt class="py-op">)</tt><tt class="py-op">=</tt><tt class="py-name">l</tt> </tt>
<a name="L660"></a><tt class="py-lineno">660</tt>  <tt class="py-line"> </tt>
<a name="L661"></a><tt class="py-lineno">661</tt>  <tt class="py-line">        <tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">scaling</tt><tt class="py-op">=</tt><tt class="py-op">[</tt><tt id="link-336" class="py-name"><a title="p4vasp.Structure.Structure.scale" class="py-name" href="#" onclick="return doclink('link-336', 'scale', 'link-335');">scale</a></tt><tt class="py-op">]</tt> </tt>
<a name="L662"></a><tt class="py-lineno">662</tt>  <tt class="py-line">        <tt class="py-name">s</tt><tt class="py-op">.</tt><tt id="link-337" class="py-name"><a title="p4vasp.Structure.Structure.setCartesian" class="py-name" href="#" onclick="return doclink('link-337', 'setCartesian', 'link-320');">setCartesian</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L663"></a><tt class="py-lineno">663</tt>  <tt class="py-line"> </tt>
<a name="L664"></a><tt class="py-lineno">664</tt>  <tt class="py-line">        <tt class="py-name">l</tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-338" class="py-name"><a title="p4vasp.db.DBI.fetchall" class="py-name" href="#" onclick="return doclink('link-338', 'fetchall', 'link-43');">fetchall</a></tt><tt class="py-op">(</tt><tt class="py-string">"SELECT specie,element,x,y,z FROM #STRUCTPOS WHERE structure_id=%d ORDER BY atomnumber"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">Id</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L665"></a><tt class="py-lineno">665</tt>  <tt class="py-line">        <tt class="py-keyword">for</tt> <tt class="py-name">spec</tt><tt class="py-op">,</tt><tt id="link-339" class="py-name"><a title="p4vasp.cStructure.AtomInfo.element" class="py-name" href="#" onclick="return doclink('link-339', 'element', 'link-328');">element</a></tt><tt class="py-op">,</tt><tt class="py-name">x</tt><tt class="py-op">,</tt><tt class="py-name">y</tt><tt class="py-op">,</tt><tt class="py-name">z</tt> <tt class="py-keyword">in</tt> <tt class="py-name">l</tt><tt class="py-op">:</tt> </tt>
<a name="L666"></a><tt class="py-lineno">666</tt>  <tt class="py-line">            <tt id="link-340" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-340', 'i', 'link-73');">i</a></tt><tt class="py-op">=</tt><tt class="py-name">s</tt><tt class="py-op">.</tt><tt id="link-341" class="py-name" targets="Method p4vasp.Structure.Structure.appendAtom()=p4vasp.Structure.Structure-class.html#appendAtom"><a title="p4vasp.Structure.Structure.appendAtom" class="py-name" href="#" onclick="return doclink('link-341', 'appendAtom', 'link-341');">appendAtom</a></tt><tt class="py-op">(</tt><tt class="py-name">spec</tt><tt class="py-op">,</tt><tt id="link-342" class="py-name"><a title="p4vasp.cmatrix.Vector
p4vasp.matrix.Vector" class="py-name" href="#" onclick="return doclink('link-342', 'Vector', 'link-9');">Vector</a></tt><tt class="py-op">(</tt><tt class="py-name">x</tt><tt class="py-op">,</tt><tt class="py-name">y</tt><tt class="py-op">,</tt><tt class="py-name">z</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L667"></a><tt class="py-lineno">667</tt>  <tt class="py-line">            <tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">info</tt><tt class="py-op">.</tt><tt id="link-343" class="py-name" targets="Method p4vasp.Structure.AtomInfo.getRecordForAtom()=p4vasp.Structure.AtomInfo-class.html#getRecordForAtom,Method p4vasp.Structure.Structure.getRecordForAtom()=p4vasp.Structure.Structure-class.html#getRecordForAtom"><a title="p4vasp.Structure.AtomInfo.getRecordForAtom
p4vasp.Structure.Structure.getRecordForAtom" class="py-name" href="#" onclick="return doclink('link-343', 'getRecordForAtom', 'link-343');">getRecordForAtom</a></tt><tt class="py-op">(</tt><tt id="link-344" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-344', 'i', 'link-73');">i</a></tt><tt class="py-op">)</tt><tt class="py-op">.</tt><tt id="link-345" class="py-name"><a title="p4vasp.cStructure.AtomInfo.element" class="py-name" href="#" onclick="return doclink('link-345', 'element', 'link-328');">element</a></tt><tt class="py-op">=</tt><tt class="py-name">str</tt><tt class="py-op">(</tt><tt id="link-346" class="py-name"><a title="p4vasp.cStructure.AtomInfo.element" class="py-name" href="#" onclick="return doclink('link-346', 'element', 'link-328');">element</a></tt><tt class="py-op">)</tt> </tt>
<a name="L668"></a><tt class="py-lineno">668</tt>  <tt class="py-line"> </tt>
<a name="L669"></a><tt class="py-lineno">669</tt>  <tt class="py-line">        <tt class="py-name">l</tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-347" class="py-name"><a title="p4vasp.db.DBI.fetchall" class="py-name" href="#" onclick="return doclink('link-347', 'fetchall', 'link-43');">fetchall</a></tt><tt class="py-op">(</tt><tt class="py-string">"SELECT x,y,z FROM #STRUCTCONSTRAINTS WHERE structure_id=%d ORDER BY atomnumber"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">Id</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L670"></a><tt class="py-lineno">670</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt id="link-348" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-348', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">l</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L671"></a><tt class="py-lineno">671</tt>  <tt class="py-line">            <tt class="py-name">s</tt><tt class="py-op">.</tt><tt id="link-349" class="py-name" targets="Method p4vasp.Structure.Structure.setSelective()=p4vasp.Structure.Structure-class.html#setSelective,Method p4vasp.cStructure.Structure.setSelective()=p4vasp.cStructure.Structure-class.html#setSelective"><a title="p4vasp.Structure.Structure.setSelective
p4vasp.cStructure.Structure.setSelective" class="py-name" href="#" onclick="return doclink('link-349', 'setSelective', 'link-349');">setSelective</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L672"></a><tt class="py-lineno">672</tt>  <tt class="py-line">            <tt class="py-keyword">for</tt> <tt id="link-350" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-350', 'i', 'link-73');">i</a></tt> <tt class="py-keyword">in</tt> <tt class="py-name">range</tt><tt class="py-op">(</tt><tt id="link-351" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-351', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">l</tt><tt class="py-op">)</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L673"></a><tt class="py-lineno">673</tt>  <tt class="py-line">                <tt class="py-name">s</tt><tt class="py-op">.</tt><tt class="py-name">selective</tt><tt class="py-op">[</tt><tt id="link-352" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-352', 'i', 'link-73');">i</a></tt><tt class="py-op">]</tt><tt class="py-op">=</tt><tt class="py-op">[</tt><tt class="py-name">int</tt><tt class="py-op">(</tt><tt class="py-name">l</tt><tt class="py-op">[</tt><tt id="link-353" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-353', 'i', 'link-73');">i</a></tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">)</tt><tt class="py-op">,</tt><tt class="py-name">int</tt><tt class="py-op">(</tt><tt class="py-name">l</tt><tt class="py-op">[</tt><tt id="link-354" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-354', 'i', 'link-73');">i</a></tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">]</tt><tt class="py-op">)</tt><tt class="py-op">,</tt><tt class="py-name">int</tt><tt class="py-op">(</tt><tt class="py-name">l</tt><tt class="py-op">[</tt><tt id="link-355" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-355', 'i', 'link-73');">i</a></tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">2</tt><tt class="py-op">]</tt><tt class="py-op">)</tt><tt class="py-op">]</tt> </tt>
<a name="L674"></a><tt class="py-lineno">674</tt>  <tt class="py-line"> </tt>
<a name="L675"></a><tt class="py-lineno">675</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt class="py-name">cstructure</tt><tt class="py-op">:</tt> </tt>
<a name="L676"></a><tt class="py-lineno">676</tt>  <tt class="py-line">            <tt class="py-name">s</tt><tt class="py-op">=</tt><tt id="link-356" class="py-name"><a title="p4vasp" class="py-name" href="#" onclick="return doclink('link-356', 'p4vasp', 'link-1');">p4vasp</a></tt><tt class="py-op">.</tt><tt id="link-357" class="py-name"><a title="p4vasp.cStructure" class="py-name" href="#" onclick="return doclink('link-357', 'cStructure', 'link-6');">cStructure</a></tt><tt class="py-op">.</tt><tt id="link-358" class="py-name"><a title="p4vasp.Structure
p4vasp.Structure.Structure
p4vasp.cStructure.Structure" class="py-name" href="#" onclick="return doclink('link-358', 'Structure', 'link-3');">Structure</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt> </tt>
<a name="L677"></a><tt class="py-lineno">677</tt>  <tt class="py-line"> </tt>
<a name="L678"></a><tt class="py-lineno">678</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-name">s</tt> </tt>
</div><a name="L679"></a><tt class="py-lineno">679</tt>  <tt class="py-line"> </tt>
<a name="P4VMixin.removeForce"></a><div id="P4VMixin.removeForce-def"><a name="L680"></a><tt class="py-lineno">680</tt> <a class="py-toggle" href="#" id="P4VMixin.removeForce-toggle" onclick="return toggle('P4VMixin.removeForce');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.P4VMixin-class.html#removeForce">removeForce</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">structure_id</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="P4VMixin.removeForce-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="P4VMixin.removeForce-expanded"><a name="L681"></a><tt class="py-lineno">681</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-359" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-359', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">"DELETE FROM #STRUCTFORCE WHERE structure_id=%d"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">structure_id</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L682"></a><tt class="py-lineno">682</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-360" class="py-name"><a title="p4vasp.db.DBI.commit
p4vasp.db.DBIContainer.commit
p4vasp.db.MySQLDBI.commit" class="py-name" href="#" onclick="return doclink('link-360', 'commit', 'link-67');">commit</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
</div><a name="L683"></a><tt class="py-lineno">683</tt>  <tt class="py-line"> </tt>
<a name="P4VMixin.readForce"></a><div id="P4VMixin.readForce-def"><a name="L684"></a><tt class="py-lineno">684</tt> <a class="py-toggle" href="#" id="P4VMixin.readForce-toggle" onclick="return toggle('P4VMixin.readForce');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.P4VMixin-class.html#readForce">readForce</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">structure_id</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="P4VMixin.readForce-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="P4VMixin.readForce-expanded"><a name="L685"></a><tt class="py-lineno">685</tt>  <tt class="py-line">        <tt class="py-keyword">from</tt> <tt id="link-361" class="py-name"><a title="p4vasp.matrix" class="py-name" href="#" onclick="return doclink('link-361', 'matrix', 'link-8');">matrix</a></tt> <tt class="py-keyword">import</tt> <tt id="link-362" class="py-name"><a title="p4vasp.cmatrix.Vector
p4vasp.matrix.Vector" class="py-name" href="#" onclick="return doclink('link-362', 'Vector', 'link-9');">Vector</a></tt> </tt>
<a name="L686"></a><tt class="py-lineno">686</tt>  <tt class="py-line">        <tt class="py-name">force</tt><tt class="py-op">=</tt><tt class="py-op">[</tt><tt class="py-op">]</tt> </tt>
<a name="L687"></a><tt class="py-lineno">687</tt>  <tt class="py-line"> </tt>
<a name="L688"></a><tt class="py-lineno">688</tt>  <tt class="py-line">        <tt class="py-name">l</tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-363" class="py-name"><a title="p4vasp.db.DBI.fetchall" class="py-name" href="#" onclick="return doclink('link-363', 'fetchall', 'link-43');">fetchall</a></tt><tt class="py-op">(</tt><tt class="py-string">"SELECT x,y,z FROM #STRUCTFORCE WHERE structure_id=%d ORDER BY atomnumber"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">structure_id</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L689"></a><tt class="py-lineno">689</tt>  <tt class="py-line">        <tt class="py-keyword">for</tt> <tt class="py-name">x</tt><tt class="py-op">,</tt><tt class="py-name">y</tt><tt class="py-op">,</tt><tt class="py-name">z</tt> <tt class="py-keyword">in</tt> <tt class="py-name">l</tt><tt class="py-op">:</tt> </tt>
<a name="L690"></a><tt class="py-lineno">690</tt>  <tt class="py-line">            <tt class="py-name">force</tt><tt class="py-op">.</tt><tt id="link-364" class="py-name"><a title="p4vasp.Structure.AtomInfo.append
p4vasp.Structure.Structure.append
p4vasp.cStructure.AtomInfo.append
p4vasp.cStructure.Structure.append
p4vasp.graph.Graph.append
p4vasp.graph.World.append
p4vasp.repository.Repository.append" class="py-name" href="#" onclick="return doclink('link-364', 'append', 'link-84');">append</a></tt><tt class="py-op">(</tt><tt id="link-365" class="py-name"><a title="p4vasp.cmatrix.Vector
p4vasp.matrix.Vector" class="py-name" href="#" onclick="return doclink('link-365', 'Vector', 'link-9');">Vector</a></tt><tt class="py-op">(</tt><tt class="py-name">x</tt><tt class="py-op">,</tt><tt class="py-name">y</tt><tt class="py-op">,</tt><tt class="py-name">z</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L691"></a><tt class="py-lineno">691</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-name">force</tt> </tt>
</div><a name="L692"></a><tt class="py-lineno">692</tt>  <tt class="py-line"> </tt>
<a name="P4VMixin.storeForce"></a><div id="P4VMixin.storeForce-def"><a name="L693"></a><tt class="py-lineno">693</tt> <a class="py-toggle" href="#" id="P4VMixin.storeForce-toggle" onclick="return toggle('P4VMixin.storeForce');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.P4VMixin-class.html#storeForce">storeForce</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">force</tt><tt class="py-op">,</tt><tt class="py-param">structure_id</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="P4VMixin.storeForce-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="P4VMixin.storeForce-expanded"><a name="L694"></a><tt class="py-lineno">694</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt class="py-keyword">not</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-366" class="py-name"><a title="p4vasp.db.DBI.fetchvalue
p4vasp.db.DBIContainer.fetchvalue" class="py-name" href="#" onclick="return doclink('link-366', 'fetchvalue', 'link-65');">fetchvalue</a></tt><tt class="py-op">(</tt><tt class="py-string">"SELECT count(*) FROM #STRUCT WHERE id=%d"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">structure_id</tt><tt class="py-op">)</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L695"></a><tt class="py-lineno">695</tt>  <tt class="py-line">            <tt class="py-keyword">raise</tt> <tt class="py-name">Exception</tt><tt class="py-op">(</tt><tt class="py-string">"Can't store the force for a nonexistend Structure structure_id=%d"</tt><tt class="py-op">%</tt><tt class="py-name">structure_id</tt><tt class="py-op">)</tt> </tt>
<a name="L696"></a><tt class="py-lineno">696</tt>  <tt class="py-line"> </tt>
<a name="L697"></a><tt class="py-lineno">697</tt>  <tt class="py-line">        <tt class="py-name">calc_id</tt> <tt class="py-op">=</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-367" class="py-name"><a title="p4vasp.db.DBI.fetchvalue
p4vasp.db.DBIContainer.fetchvalue" class="py-name" href="#" onclick="return doclink('link-367', 'fetchvalue', 'link-65');">fetchvalue</a></tt><tt class="py-op">(</tt><tt class="py-string">"SELECT calc_id FROM #STRUCT WHERE id=%d"</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">structure_id</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L698"></a><tt class="py-lineno">698</tt>  <tt class="py-line"> </tt>
<a name="L699"></a><tt class="py-lineno">699</tt>  <tt class="py-line">        <tt class="py-keyword">for</tt> <tt id="link-368" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-368', 'i', 'link-73');">i</a></tt> <tt class="py-keyword">in</tt> <tt class="py-name">range</tt><tt class="py-op">(</tt><tt id="link-369" class="py-name"><a title="p4vasp.cStructure.Structure.len" class="py-name" href="#" onclick="return doclink('link-369', 'len', 'link-28');">len</a></tt><tt class="py-op">(</tt><tt class="py-name">force</tt><tt class="py-op">)</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L700"></a><tt class="py-lineno">700</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-370" class="py-name"><a title="p4vasp.db.DBI.exe
p4vasp.db.DBIContainer.exe" class="py-name" href="#" onclick="return doclink('link-370', 'exe', 'link-58');">exe</a></tt><tt class="py-op">(</tt><tt class="py-string">"""INSERT INTO #STRUCTFORCE (structure_id,calc_id,atomnumber,x,y,z)</tt> </tt>
<a name="L701"></a><tt class="py-lineno">701</tt>  <tt class="py-line"><tt class="py-string">            VALUES (%d,%s,%d,%14.12f,%14.12f,%14.12f)"""</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">structure_id</tt><tt class="py-op">,</tt><tt id="link-371" class="py-name"><a title="p4vasp.db.von" class="py-name" href="#" onclick="return doclink('link-371', 'von', 'link-305');">von</a></tt><tt class="py-op">(</tt><tt class="py-name">calc_id</tt><tt class="py-op">)</tt><tt class="py-op">,</tt><tt id="link-372" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-372', 'i', 'link-73');">i</a></tt><tt class="py-op">,</tt> </tt>
<a name="L702"></a><tt class="py-lineno">702</tt>  <tt class="py-line">            <tt class="py-name">force</tt><tt class="py-op">[</tt><tt id="link-373" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-373', 'i', 'link-73');">i</a></tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">0</tt><tt class="py-op">]</tt><tt class="py-op">,</tt> <tt class="py-name">force</tt><tt class="py-op">[</tt><tt id="link-374" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-374', 'i', 'link-73');">i</a></tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">]</tt><tt class="py-op">,</tt> <tt class="py-name">force</tt><tt class="py-op">[</tt><tt id="link-375" class="py-name"><a title="p4vasp.paint3d.OpenGLPaint3D.i" class="py-name" href="#" onclick="return doclink('link-375', 'i', 'link-73');">i</a></tt><tt class="py-op">]</tt><tt class="py-op">[</tt><tt class="py-number">2</tt><tt class="py-op">]</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L703"></a><tt class="py-lineno">703</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-376" class="py-name"><a title="p4vasp.db.DBI.commit
p4vasp.db.DBIContainer.commit
p4vasp.db.MySQLDBI.commit" class="py-name" href="#" onclick="return doclink('link-376', 'commit', 'link-67');">commit</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L704"></a><tt class="py-lineno">704</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt class="py-name">structure_id</tt> </tt>
</div></div><a name="L705"></a><tt class="py-lineno">705</tt>  <tt class="py-line"> </tt>
<a name="SQLiteDBI"></a><div id="SQLiteDBI-def"><a name="L706"></a><tt class="py-lineno">706</tt> <a class="py-toggle" href="#" id="SQLiteDBI-toggle" onclick="return toggle('SQLiteDBI');">-</a><tt class="py-line"><tt class="py-keyword">class</tt> <a class="py-def-name" href="p4vasp.db.SQLiteDBI-class.html">SQLiteDBI</a><tt class="py-op">(</tt><tt class="py-base-class">P4VMixin</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="SQLiteDBI-collapsed" style="display:none;" pad="+++" indent="++++"></div><div id="SQLiteDBI-expanded"><a name="SQLiteDBI.__init__"></a><div id="SQLiteDBI.__init__-def"><a name="L707"></a><tt class="py-lineno">707</tt> <a class="py-toggle" href="#" id="SQLiteDBI.__init__-toggle" onclick="return toggle('SQLiteDBI.__init__');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.SQLiteDBI-class.html#__init__">__init__</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">db</tt><tt class="py-op">=</tt><tt class="py-name">None</tt><tt class="py-op">,</tt><tt class="py-param">connect</tt><tt class="py-op">=</tt><tt class="py-number">1</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="SQLiteDBI.__init__-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="SQLiteDBI.__init__-expanded"><a name="L708"></a><tt class="py-lineno">708</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt class="py-name">type</tt><tt class="py-op">(</tt><tt id="link-377" class="py-name"><a title="p4vasp.db" class="py-name" href="#" onclick="return doclink('link-377', 'db', 'link-10');">db</a></tt><tt class="py-op">)</tt><tt class="py-op">==</tt><tt class="py-name">type</tt><tt class="py-op">(</tt><tt class="py-string">""</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L709"></a><tt class="py-lineno">709</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-378" class="py-name"><a title="p4vasp.Array.path
p4vasp.Dictionary.path
p4vasp.Structure.path
p4vasp.applet.Applet.path
p4vasp.message.path
p4vasp.repository.path
p4vasp.schedule'.path
p4vasp.store.path
p4vasp.util.path" class="py-name" href="#" onclick="return doclink('link-378', 'path', 'link-0');">path</a></tt><tt class="py-op">=</tt><tt id="link-379" class="py-name"><a title="p4vasp.db" class="py-name" href="#" onclick="return doclink('link-379', 'db', 'link-10');">db</a></tt> </tt>
<a name="L710"></a><tt class="py-lineno">710</tt>  <tt class="py-line">            <tt id="link-380" class="py-name" targets="Class p4vasp.db.DBI=p4vasp.db.DBI-class.html"><a title="p4vasp.db.DBI" class="py-name" href="#" onclick="return doclink('link-380', 'DBI', 'link-380');">DBI</a></tt><tt class="py-op">.</tt><tt id="link-381" class="py-name" targets="Method p4vasp.Array.Array.__init__()=p4vasp.Array.Array-class.html#__init__,Method p4vasp.Array.ArrayRecord.__init__()=p4vasp.Array.ArrayRecord-class.html#__init__,Method p4vasp.Array.LateList.__init__()=p4vasp.Array.LateList-class.html#__init__,Method p4vasp.Array.SetLateList.__init__()=p4vasp.Array.SetLateList-class.html#__init__,Method p4vasp.Array.VArray.__init__()=p4vasp.Array.VArray-class.html#__init__,Method p4vasp.Array.rRecordSetLateList.__init__()=p4vasp.Array.rRecordSetLateList-class.html#__init__,Method p4vasp.Array.rcRecordSetLateList.__init__()=p4vasp.Array.rcRecordSetLateList-class.html#__init__,Method p4vasp.ConvexShape.ConvexShape.__init__()=p4vasp.ConvexShape.ConvexShape-class.html#__init__,Method p4vasp.Dictionary.Dictionary.__init__()=p4vasp.Dictionary.Dictionary-class.html#__init__,Method p4vasp.Dictionary.Incar.__init__()=p4vasp.Dictionary.Incar-class.html#__init__,Method p4vasp.Dictionary.StructuredDictionary.__init__()=p4vasp.Dictionary.StructuredDictionary-class.html#__init__,Method p4vasp.FArray.FArray1D.__init__()=p4vasp.FArray.FArray1D-class.html#__init__,Method p4vasp.FArray.FArray2D.__init__()=p4vasp.FArray.FArray2D-class.html#__init__,Method p4vasp.GraphCanvas.Export.__init__()=p4vasp.GraphCanvas.Export-class.html#__init__,Method p4vasp.GraphCanvas.GraphCanvas.__init__()=p4vasp.GraphCanvas.GraphCanvas-class.html#__init__,Method p4vasp.GraphCanvas.GraphCanvasWindow.__init__()=p4vasp.GraphCanvas.GraphCanvasWindow-class.html#__init__,Method p4vasp.GraphCanvas_gtk1.Export.__init__()=p4vasp.GraphCanvas_gtk1.Export-class.html#__init__,Method p4vasp.GraphCanvas_gtk1.GraphCanvas.__init__()=p4vasp.GraphCanvas_gtk1.GraphCanvas-class.html#__init__,Method p4vasp.GraphCanvas_gtk1.GraphCanvasWindow.__init__()=p4vasp.GraphCanvas_gtk1.GraphCanvasWindow-class.html#__init__,Method p4vasp.GraphPM.GraphPM.__init__()=p4vasp.GraphPM.GraphPM-class.html#__init__,Method p4vasp.GraphPM.GraphProperty.__init__()=p4vasp.GraphPM.GraphProperty-class.html#__init__,Method p4vasp.ODPdom.Attr.__init__()=p4vasp.ODPdom.Attr-class.html#__init__,Method p4vasp.ODPdom.AttributeList.__init__()=p4vasp.ODPdom.AttributeList-class.html#__init__,Method p4vasp.ODPdom.CharacterData.__init__()=p4vasp.ODPdom.CharacterData-class.html#__init__,Method p4vasp.ODPdom.ChildrenByTagNameList.__init__()=p4vasp.ODPdom.ChildrenByTagNameList-class.html#__init__,Method p4vasp.ODPdom.DOMException.__init__()=p4vasp.ODPdom.DOMException-class.html#__init__,Method p4vasp.ODPdom.Document.__init__()=p4vasp.ODPdom.Document-class.html#__init__,Method p4vasp.ODPdom.Element.__init__()=p4vasp.ODPdom.Element-class.html#__init__,Method p4vasp.ODPdom.NamedNodeMap.__init__()=p4vasp.ODPdom.NamedNodeMap-class.html#__init__,Method p4vasp.ODPdom.Node.__init__()=p4vasp.ODPdom.Node-class.html#__init__,Method p4vasp.ODPdom.NodeList.__init__()=p4vasp.ODPdom.NodeList-class.html#__init__,Method p4vasp.ODPdom.ProcessingInstruction.__init__()=p4vasp.ODPdom.ProcessingInstruction-class.html#__init__,Method p4vasp.Property.FilterPropertyManager.__init__()=p4vasp.Property.FilterPropertyManager-class.html#__init__,Method p4vasp.Property.Property.__init__()=p4vasp.Property.Property-class.html#__init__,Method p4vasp.Property.PropertyManager.__init__()=p4vasp.Property.PropertyManager-class.html#__init__,Method p4vasp.SQLSystemPM.SQLForcesSequenceLateList.__init__()=p4vasp.SQLSystemPM.SQLForcesSequenceLateList-class.html#__init__,Method p4vasp.SQLSystemPM.SQLStructuresLL.__init__()=p4vasp.SQLSystemPM.SQLStructuresLL-class.html#__init__,Method p4vasp.SQLSystemPM.SQLSystemPM.__init__()=p4vasp.SQLSystemPM.SQLSystemPM-class.html#__init__,Method p4vasp.Selection.Selection.__init__()=p4vasp.Selection.Selection-class.html#__init__,Method p4vasp.Structure.AtomInfo.__init__()=p4vasp.Structure.AtomInfo-class.html#__init__,Method p4vasp.Structure.AtomtypesArray.__init__()=p4vasp.Structure.AtomtypesArray-class.html#__init__,Method p4vasp.Structure.AtomtypesRecord.__init__()=p4vasp.Structure.AtomtypesRecord-class.html#__init__,Method p4vasp.Structure.Structure.__init__()=p4vasp.Structure.Structure-class.html#__init__,Method p4vasp.StructureWindow.StructureWindow.__init__()=p4vasp.StructureWindow.StructureWindow-class.html#__init__,Method p4vasp.SystemPM.ChgcarStatisticsLateList.__init__()=p4vasp.SystemPM.ChgcarStatisticsLateList-class.html#__init__,Method p4vasp.SystemPM.KpointGeneration.__init__()=p4vasp.SystemPM.KpointGeneration-class.html#__init__,Method p4vasp.SystemPM.KpointList.__init__()=p4vasp.SystemPM.KpointList-class.html#__init__,Method p4vasp.SystemPM.Kpoints.__init__()=p4vasp.SystemPM.Kpoints-class.html#__init__,Method p4vasp.SystemPM.OldSystemPM.__init__()=p4vasp.SystemPM.OldSystemPM-class.html#__init__,Method p4vasp.SystemPM.PoscarSystemPM.__init__()=p4vasp.SystemPM.PoscarSystemPM-class.html#__init__,Method p4vasp.SystemPM.SetupPM.__init__()=p4vasp.SystemPM.SetupPM-class.html#__init__,Method p4vasp.SystemPM.StructureSequenceLateList.__init__()=p4vasp.SystemPM.StructureSequenceLateList-class.html#__init__,Method p4vasp.SystemPM.SystemPM.__init__()=p4vasp.SystemPM.SystemPM-class.html#__init__,Method p4vasp.SystemPM.SystemPM_URL_Attribute.__init__()=p4vasp.SystemPM.SystemPM_URL_Attribute-class.html#__init__,Method p4vasp.SystemPM.SystemRepository.__init__()=p4vasp.SystemPM.SystemRepository-class.html#__init__,Method p4vasp.SystemPM.XMLSystemPM.__init__()=p4vasp.SystemPM.XMLSystemPM-class.html#__init__,Method p4vasp.SystemPM.cStructureSequenceLateList.__init__()=p4vasp.SystemPM.cStructureSequenceLateList-class.html#__init__,Method p4vasp.applet.Applet.Applet.__init__()=p4vasp.applet.Applet.Applet-class.html#__init__,Method p4vasp.applet.Applet.AppletProfile.__init__()=p4vasp.applet.Applet.AppletProfile-class.html#__init__,Method p4vasp.applet.Applet.GraphApplet.__init__()=p4vasp.applet.Applet.GraphApplet-class.html#__init__,Method p4vasp.applet.Applet.TextApplet.__init__()=p4vasp.applet.Applet.TextApplet-class.html#__init__,Method p4vasp.applet.Applet.Widgets.__init__()=p4vasp.applet.Applet.Widgets-class.html#__init__,Method p4vasp.applet.AppletRepositoryProfile.__init__()=p4vasp.applet.AppletRepositoryProfile-class.html#__init__,Method p4vasp.applet.AppletTree.AppletNode.__init__()=p4vasp.applet.AppletTree.AppletNode-class.html#__init__,Method p4vasp.applet.AppletTree.AppletTree.__init__()=p4vasp.applet.AppletTree.AppletTree-class.html#__init__,Method 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p4vasp.paint3d.Paint3DInterface.Paint3DInterface.__init__
p4vasp.paint3d.Paint3DInterface.Paint3DRecorder.__init__
p4vasp.paint3d.PovrayPaint3D.ExtendedPovrayPaint3D.__init__
p4vasp.paint3d.PovrayPaint3D.PovrayPaint3D.__init__
p4vasp.paint3d.PovrayPaint3D.PovrayPaint3DFrame.__init__
p4vasp.paint3d.data.AmbientLight.__init__
p4vasp.paint3d.data.Arrow.__init__
p4vasp.paint3d.data.Background.__init__
p4vasp.paint3d.data.ColorMaterial.__init__
p4vasp.paint3d.data.Cone.__init__
p4vasp.paint3d.data.Cylinder.__init__
p4vasp.paint3d.data.Frame.__init__
p4vasp.paint3d.data.Line.__init__
p4vasp.paint3d.data.Mesh.__init__
p4vasp.paint3d.data.OrthographicCamera.__init__
p4vasp.paint3d.data.PerspectiveCamera.__init__
p4vasp.paint3d.data.PointLight.__init__
p4vasp.paint3d.data.Sphere.__init__
p4vasp.repository.Descriptor.__init__
p4vasp.repository.DescriptorProfile.__init__
p4vasp.repository.Factory.__init__
p4vasp.repository.FactoryProfile.__init__
p4vasp.repository.Repository.__init__
p4vasp.repository.RepositoryProfile.__init__
p4vasp.schedule'.Scheduler.__init__
p4vasp.setupstore.SetupProfile.__init__
p4vasp.setupstore.SetupProfile_old.__init__
p4vasp.store.AttributeProfile.__init__
p4vasp.store.ClassAttribute.__init__
p4vasp.store.FloatAttribute.__init__
p4vasp.store.FloatListAttribute.__init__
p4vasp.store.FloatTupleAttribute.__init__
p4vasp.store.HexMarshalAttribute.__init__
p4vasp.store.HexPickleAttribute.__init__
p4vasp.store.IgnoreProfile.__init__
p4vasp.store.IntAttribute.__init__
p4vasp.store.IntListAttribute.__init__
p4vasp.store.IntTupleAttribute.__init__
p4vasp.store.ListAttribute.__init__
p4vasp.store.Profile.__init__
p4vasp.store.StringAttribute.__init__
p4vasp.store.StringListAttribute.__init__
p4vasp.util.ParseException.__init__
p4vasp.util.UnknownType.__init__
p4vasp.util.XMLParseException.__init__
p4vasp.uuid.UuidGen.__init__
p4vasp.uuid._GeneratorState.__init__" class="py-name" href="#" onclick="return doclink('link-381', '__init__', 'link-381');">__init__</a></tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">,</tt><tt id="link-382" class="py-name"><a title="p4vasp.db.DBI.connect
p4vasp.db.DBIContainer.connect
p4vasp.db.MySQLDBI.connect
p4vasp.db.SQLiteDBI.connect" class="py-name" href="#" onclick="return doclink('link-382', 'connect', 'link-14');">connect</a></tt><tt class="py-op">=</tt><tt id="link-383" class="py-name"><a title="p4vasp.db.DBI.connect
p4vasp.db.DBIContainer.connect
p4vasp.db.MySQLDBI.connect
p4vasp.db.SQLiteDBI.connect" class="py-name" href="#" onclick="return doclink('link-383', 'connect', 'link-14');">connect</a></tt><tt class="py-op">)</tt> </tt>
<a name="L711"></a><tt class="py-lineno">711</tt>  <tt class="py-line">        <tt class="py-keyword">else</tt><tt class="py-op">:</tt> </tt>
<a name="L712"></a><tt class="py-lineno">712</tt>  <tt class="py-line">            <tt id="link-384" class="py-name"><a title="p4vasp.db.DBI" class="py-name" href="#" onclick="return doclink('link-384', 'DBI', 'link-380');">DBI</a></tt><tt class="py-op">.</tt><tt id="link-385" class="py-name"><a title="p4vasp.Array.Array.__init__
p4vasp.Array.ArrayRecord.__init__
p4vasp.Array.LateList.__init__
p4vasp.Array.SetLateList.__init__
p4vasp.Array.VArray.__init__
p4vasp.Array.rRecordSetLateList.__init__
p4vasp.Array.rcRecordSetLateList.__init__
p4vasp.ConvexShape.ConvexShape.__init__
p4vasp.Dictionary.Dictionary.__init__
p4vasp.Dictionary.Incar.__init__
p4vasp.Dictionary.StructuredDictionary.__init__
p4vasp.FArray.FArray1D.__init__
p4vasp.FArray.FArray2D.__init__
p4vasp.GraphCanvas.Export.__init__
p4vasp.GraphCanvas.GraphCanvas.__init__
p4vasp.GraphCanvas.GraphCanvasWindow.__init__
p4vasp.GraphCanvas_gtk1.Export.__init__
p4vasp.GraphCanvas_gtk1.GraphCanvas.__init__
p4vasp.GraphCanvas_gtk1.GraphCanvasWindow.__init__
p4vasp.GraphPM.GraphPM.__init__
p4vasp.GraphPM.GraphProperty.__init__
p4vasp.ODPdom.Attr.__init__
p4vasp.ODPdom.AttributeList.__init__
p4vasp.ODPdom.CharacterData.__init__
p4vasp.ODPdom.ChildrenByTagNameList.__init__
p4vasp.ODPdom.DOMException.__init__
p4vasp.ODPdom.Document.__init__
p4vasp.ODPdom.Element.__init__
p4vasp.ODPdom.NamedNodeMap.__init__
p4vasp.ODPdom.Node.__init__
p4vasp.ODPdom.NodeList.__init__
p4vasp.ODPdom.ProcessingInstruction.__init__
p4vasp.Property.FilterPropertyManager.__init__
p4vasp.Property.Property.__init__
p4vasp.Property.PropertyManager.__init__
p4vasp.SQLSystemPM.SQLForcesSequenceLateList.__init__
p4vasp.SQLSystemPM.SQLStructuresLL.__init__
p4vasp.SQLSystemPM.SQLSystemPM.__init__
p4vasp.Selection.Selection.__init__
p4vasp.Structure.AtomInfo.__init__
p4vasp.Structure.AtomtypesArray.__init__
p4vasp.Structure.AtomtypesRecord.__init__
p4vasp.Structure.Structure.__init__
p4vasp.StructureWindow.StructureWindow.__init__
p4vasp.SystemPM.ChgcarStatisticsLateList.__init__
p4vasp.SystemPM.KpointGeneration.__init__
p4vasp.SystemPM.KpointList.__init__
p4vasp.SystemPM.Kpoints.__init__
p4vasp.SystemPM.OldSystemPM.__init__
p4vasp.SystemPM.PoscarSystemPM.__init__
p4vasp.SystemPM.SetupPM.__init__
p4vasp.SystemPM.StructureSequenceLateList.__init__
p4vasp.SystemPM.SystemPM.__init__
p4vasp.SystemPM.SystemPM_URL_Attribute.__init__
p4vasp.SystemPM.SystemRepository.__init__
p4vasp.SystemPM.XMLSystemPM.__init__
p4vasp.SystemPM.cStructureSequenceLateList.__init__
p4vasp.applet.Applet.Applet.__init__
p4vasp.applet.Applet.AppletProfile.__init__
p4vasp.applet.Applet.GraphApplet.__init__
p4vasp.applet.Applet.TextApplet.__init__
p4vasp.applet.Applet.Widgets.__init__
p4vasp.applet.AppletRepositoryProfile.__init__
p4vasp.applet.AppletTree.AppletNode.__init__
p4vasp.applet.AppletTree.AppletTree.__init__
p4vasp.applet.AppletTree.AppletTreeModel.__init__
p4vasp.applet.AppletTree.AppletTreeStoreProfile.__init__
p4vasp.applet.AppletTree_old.AppletNode.__init__
p4vasp.applet.AppletTree_old.AppletTree.__init__
p4vasp.applet.AppletTree_old.AppletTreeStoreProfile.__init__
p4vasp.applet.BuilderApplet.BuilderApplet.__init__
p4vasp.applet.BuilderApplet.StructureTreeModel.__init__
p4vasp.applet.CommitApplet.CommitApplet.__init__
p4vasp.applet.DBApplet.DBApplet.__init__
p4vasp.applet.DBApplet.QueryTreeModel.__init__
p4vasp.applet.DielectricApplet.DielectricApplet.__init__
p4vasp.applet.EditSubZMatApplet.EditSubZMatApplet.__init__
p4vasp.applet.ElectronicApplet.ElectronicApplet.__init__
p4vasp.applet.ElectronicApplet.Line.__init__
p4vasp.applet.ElectronicControlApplet.ElectronicControlApplet.__init__
p4vasp.applet.EnergyConvergenceApplet.EnergyConvergenceApplet.__init__
p4vasp.applet.ExportApplet.ExportApplet.__init__
p4vasp.applet.ForcesConvergenceApplet.ForcesConvergenceApplet.__init__
p4vasp.applet.GraphWindowApplet.GraphWindowApplet.__init__
p4vasp.applet.InfoApplet.InfoApplet.__init__
p4vasp.applet.KpointsViewerApplet.KpointsViewerApplet.__init__
p4vasp.applet.LatticeApplet.LatticeApplet.__init__
p4vasp.applet.LocalPotentialApplet.LocalPotentialApplet.__init__
p4vasp.applet.MeasureApplet.DistanceTreeModel.__init__
p4vasp.applet.MeasureApplet.MeasureApplet.__init__
p4vasp.applet.MoveApplet.MoveApplet.__init__
p4vasp.applet.MultiplyCellApplet.MultiplyCellApplet.__init__
p4vasp.applet.NewApplet.NewApplet.__init__
p4vasp.applet.RotateApplet.RotateApplet.__init__
p4vasp.applet.STMWindowApplet.STMWindowApplet.__init__
p4vasp.applet.STMWindowControlApplet.STMWindowControlApplet.__init__
p4vasp.applet.SelForcesConvergenceApplet.SelForcesConvergenceApplet.__init__
p4vasp.applet.SelectionApplet.SelectionApplet.__init__
p4vasp.applet.ShowHideControlApplet.ShowHideControlApplet.__init__
p4vasp.applet.StructureApplet.Measure.__init__
p4vasp.applet.StructureApplet.StructureApplet.__init__
p4vasp.applet.StructureApplet.SubtrSequence.__init__
p4vasp.applet.StructureWindowApplet.StructureWindowApplet.__init__
p4vasp.applet.StructureWindowControlApplet.StructureWindowControlApplet.__init__
p4vasp.applet.StructureWindowControlApplet.SubtrSequence.__init__
p4vasp.applet.VACApplet.VACApplet.__init__
p4vasp.cStructure.AtomInfo.__init__
p4vasp.cStructure.AtomtypesRecord.__init__
p4vasp.cStructure.SelectiveArrayItemWrapper.__init__
p4vasp.cStructure.SelectiveArrayWrapper.__init__
p4vasp.cStructure.Structure.__init__
p4vasp.cmatrix.Matrix.__init__
p4vasp.cmatrix.Vector.__init__
p4vasp.db.DBI.__init__
p4vasp.db.MySQLDBI.__init__
p4vasp.db.Query.__init__
p4vasp.db.SQLiteDBI.__init__
p4vasp.graph.Axis.__init__
p4vasp.graph.Graph.__init__
p4vasp.graph.GraphLine.__init__
p4vasp.graph.Set.__init__
p4vasp.graph.World.__init__
p4vasp.graph.XAxis.__init__
p4vasp.graph.YAxis.__init__
p4vasp.matrix.Matrix.__init__
p4vasp.matrix.Vector.__init__
p4vasp.message.MessageDriver.__init__
p4vasp.paint3d.ColladaPaint3D.ColladaEffectsPaint3D.__init__
p4vasp.paint3d.ColladaPaint3D.ColladaGeometriesPaint3D.__init__
p4vasp.paint3d.ColladaPaint3D.ColladaPaint3D.__init__
p4vasp.paint3d.ColladaPaint3D.ColladaScenePaint3D.__init__
p4vasp.paint3d.OpenGLPaint3D.BasicOpenGLPaint3D.__init__
p4vasp.paint3d.OpenGLPaint3D.GLUTPaint3D.__init__
p4vasp.paint3d.OpenGLPaint3D.OpenGLPaint3DFrame.__init__
p4vasp.paint3d.OpenGLPaint3D.OpenGLPaint3DRecorder.__init__
p4vasp.paint3d.Paint3DInterface.Paint3DInterface.__init__
p4vasp.paint3d.Paint3DInterface.Paint3DRecorder.__init__
p4vasp.paint3d.PovrayPaint3D.ExtendedPovrayPaint3D.__init__
p4vasp.paint3d.PovrayPaint3D.PovrayPaint3D.__init__
p4vasp.paint3d.PovrayPaint3D.PovrayPaint3DFrame.__init__
p4vasp.paint3d.data.AmbientLight.__init__
p4vasp.paint3d.data.Arrow.__init__
p4vasp.paint3d.data.Background.__init__
p4vasp.paint3d.data.ColorMaterial.__init__
p4vasp.paint3d.data.Cone.__init__
p4vasp.paint3d.data.Cylinder.__init__
p4vasp.paint3d.data.Frame.__init__
p4vasp.paint3d.data.Line.__init__
p4vasp.paint3d.data.Mesh.__init__
p4vasp.paint3d.data.OrthographicCamera.__init__
p4vasp.paint3d.data.PerspectiveCamera.__init__
p4vasp.paint3d.data.PointLight.__init__
p4vasp.paint3d.data.Sphere.__init__
p4vasp.repository.Descriptor.__init__
p4vasp.repository.DescriptorProfile.__init__
p4vasp.repository.Factory.__init__
p4vasp.repository.FactoryProfile.__init__
p4vasp.repository.Repository.__init__
p4vasp.repository.RepositoryProfile.__init__
p4vasp.schedule'.Scheduler.__init__
p4vasp.setupstore.SetupProfile.__init__
p4vasp.setupstore.SetupProfile_old.__init__
p4vasp.store.AttributeProfile.__init__
p4vasp.store.ClassAttribute.__init__
p4vasp.store.FloatAttribute.__init__
p4vasp.store.FloatListAttribute.__init__
p4vasp.store.FloatTupleAttribute.__init__
p4vasp.store.HexMarshalAttribute.__init__
p4vasp.store.HexPickleAttribute.__init__
p4vasp.store.IgnoreProfile.__init__
p4vasp.store.IntAttribute.__init__
p4vasp.store.IntListAttribute.__init__
p4vasp.store.IntTupleAttribute.__init__
p4vasp.store.ListAttribute.__init__
p4vasp.store.Profile.__init__
p4vasp.store.StringAttribute.__init__
p4vasp.store.StringListAttribute.__init__
p4vasp.util.ParseException.__init__
p4vasp.util.UnknownType.__init__
p4vasp.util.XMLParseException.__init__
p4vasp.uuid.UuidGen.__init__
p4vasp.uuid._GeneratorState.__init__" class="py-name" href="#" onclick="return doclink('link-385', '__init__', 'link-381');">__init__</a></tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">,</tt><tt id="link-386" class="py-name"><a title="p4vasp.db" class="py-name" href="#" onclick="return doclink('link-386', 'db', 'link-10');">db</a></tt><tt class="py-op">,</tt><tt id="link-387" class="py-name"><a title="p4vasp.db.DBI.connect
p4vasp.db.DBIContainer.connect
p4vasp.db.MySQLDBI.connect
p4vasp.db.SQLiteDBI.connect" class="py-name" href="#" onclick="return doclink('link-387', 'connect', 'link-14');">connect</a></tt><tt class="py-op">=</tt><tt id="link-388" class="py-name"><a title="p4vasp.db.DBI.connect
p4vasp.db.DBIContainer.connect
p4vasp.db.MySQLDBI.connect
p4vasp.db.SQLiteDBI.connect" class="py-name" href="#" onclick="return doclink('link-388', 'connect', 'link-14');">connect</a></tt><tt class="py-op">)</tt> </tt>
</div><a name="L713"></a><tt class="py-lineno">713</tt>  <tt class="py-line"> </tt>
<a name="SQLiteDBI.config"></a><div id="SQLiteDBI.config-def"><a name="L714"></a><tt class="py-lineno">714</tt> <a class="py-toggle" href="#" id="SQLiteDBI.config-toggle" onclick="return toggle('SQLiteDBI.config');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.SQLiteDBI-class.html#config">config</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">c</tt><tt class="py-op">,</tt><tt class="py-param">name</tt><tt class="py-op">=</tt><tt class="py-name">None</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="SQLiteDBI.config-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="SQLiteDBI.config-expanded"><a name="L715"></a><tt class="py-lineno">715</tt>  <tt class="py-line">        <tt class="py-name">cc</tt><tt class="py-op">=</tt><tt class="py-op">{</tt><tt class="py-op">}</tt> </tt>
<a name="L716"></a><tt class="py-lineno">716</tt>  <tt class="py-line">        <tt class="py-name">cc</tt><tt class="py-op">.</tt><tt id="link-389" class="py-name"><a title="p4vasp.Dictionary.StructuredDictionary.update
p4vasp.applet.Applet.GraphApplet.update
p4vasp.applet.ElectronicApplet.ElectronicApplet.update
p4vasp.applet.GraphWindowApplet.GraphWindowApplet.update" class="py-name" href="#" onclick="return doclink('link-389', 'update', 'link-21');">update</a></tt><tt class="py-op">(</tt><tt id="link-390" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-390', 'c', 'link-22');">c</a></tt><tt class="py-op">)</tt> </tt>
<a name="L717"></a><tt class="py-lineno">717</tt>  <tt class="py-line">        <tt id="link-391" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-391', 'c', 'link-22');">c</a></tt><tt class="py-op">=</tt><tt class="py-name">cc</tt> </tt>
<a name="L718"></a><tt class="py-lineno">718</tt>  <tt class="py-line">        <tt id="link-392" class="py-name"><a title="p4vasp.db.DBI" class="py-name" href="#" onclick="return doclink('link-392', 'DBI', 'link-380');">DBI</a></tt><tt class="py-op">.</tt><tt id="link-393" class="py-name" targets="Method p4vasp.db.DBI.config()=p4vasp.db.DBI-class.html#config,Method p4vasp.db.MySQLDBI.config()=p4vasp.db.MySQLDBI-class.html#config,Method p4vasp.db.SQLiteDBI.config()=p4vasp.db.SQLiteDBI-class.html#config"><a title="p4vasp.db.DBI.config
p4vasp.db.MySQLDBI.config
p4vasp.db.SQLiteDBI.config" class="py-name" href="#" onclick="return doclink('link-393', 'config', 'link-393');">config</a></tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">,</tt><tt id="link-394" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-394', 'c', 'link-22');">c</a></tt><tt class="py-op">,</tt><tt id="link-395" class="py-name"><a title="p4vasp.applet.Applet.Applet.name" class="py-name" href="#" onclick="return doclink('link-395', 'name', 'link-12');">name</a></tt><tt class="py-op">)</tt> </tt>
<a name="L719"></a><tt class="py-lineno">719</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt id="link-396" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-396', 'c', 'link-22');">c</a></tt><tt class="py-op">.</tt><tt id="link-397" class="py-name"><a title="p4vasp.Dictionary.StructuredDictionary.has_key" class="py-name" href="#" onclick="return doclink('link-397', 'has_key', 'link-17');">has_key</a></tt><tt class="py-op">(</tt><tt class="py-string">"path"</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L720"></a><tt class="py-lineno">720</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-398" class="py-name"><a title="p4vasp.db.DBI.isConnected
p4vasp.db.DBIContainer.isConnected" class="py-name" href="#" onclick="return doclink('link-398', 'isConnected', 'link-118');">isConnected</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L721"></a><tt class="py-lineno">721</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-399" class="py-name"><a title="p4vasp.db.DBI.disconnect
p4vasp.db.DBIContainer.disconnect
p4vasp.db.MySQLDBI.disconnect
p4vasp.db.SQLiteDBI.disconnect" class="py-name" href="#" onclick="return doclink('link-399', 'disconnect', 'link-139');">disconnect</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L722"></a><tt class="py-lineno">722</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-400" class="py-name"><a title="p4vasp.Array.path
p4vasp.Dictionary.path
p4vasp.Structure.path
p4vasp.applet.Applet.path
p4vasp.message.path
p4vasp.repository.path
p4vasp.schedule'.path
p4vasp.store.path
p4vasp.util.path" class="py-name" href="#" onclick="return doclink('link-400', 'path', 'link-0');">path</a></tt><tt class="py-op">=</tt><tt id="link-401" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-401', 'c', 'link-22');">c</a></tt><tt class="py-op">[</tt><tt class="py-string">"path"</tt><tt class="py-op">]</tt> </tt>
<a name="L723"></a><tt class="py-lineno">723</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-402" class="py-name"><a title="p4vasp.db.DBI.connect
p4vasp.db.DBIContainer.connect
p4vasp.db.MySQLDBI.connect
p4vasp.db.SQLiteDBI.connect" class="py-name" href="#" onclick="return doclink('link-402', 'connect', 'link-14');">connect</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L724"></a><tt class="py-lineno">724</tt>  <tt class="py-line">            <tt class="py-keyword">else</tt><tt class="py-op">:</tt> </tt>
<a name="L725"></a><tt class="py-lineno">725</tt>  <tt class="py-line">                <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-403" class="py-name"><a title="p4vasp.Array.path
p4vasp.Dictionary.path
p4vasp.Structure.path
p4vasp.applet.Applet.path
p4vasp.message.path
p4vasp.repository.path
p4vasp.schedule'.path
p4vasp.store.path
p4vasp.util.path" class="py-name" href="#" onclick="return doclink('link-403', 'path', 'link-0');">path</a></tt><tt class="py-op">=</tt><tt id="link-404" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-404', 'c', 'link-22');">c</a></tt><tt class="py-op">[</tt><tt class="py-string">"path"</tt><tt class="py-op">]</tt> </tt>
</div><a name="L726"></a><tt class="py-lineno">726</tt>  <tt class="py-line"> </tt>
<a name="SQLiteDBI.connect"></a><div id="SQLiteDBI.connect-def"><a name="L727"></a><tt class="py-lineno">727</tt> <a class="py-toggle" href="#" id="SQLiteDBI.connect-toggle" onclick="return toggle('SQLiteDBI.connect');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.SQLiteDBI-class.html#connect">connect</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="SQLiteDBI.connect-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="SQLiteDBI.connect-expanded"><a name="L728"></a><tt class="py-lineno">728</tt>  <tt class="py-line"><tt class="py-comment">#    try:</tt> </tt>
<a name="L729"></a><tt class="py-lineno">729</tt>  <tt class="py-line"><tt class="py-comment">#      import sqlite</tt> </tt>
<a name="L730"></a><tt class="py-lineno">730</tt>  <tt class="py-line"><tt class="py-comment">#    except ImportError:</tt> </tt>
<a name="L731"></a><tt class="py-lineno">731</tt>  <tt class="py-line"><tt class="py-comment">#      from pysqlite2 import dbapi2 as sqlite</tt> </tt>
<a name="L732"></a><tt class="py-lineno">732</tt>  <tt class="py-line">        <tt class="py-keyword">from</tt> <tt class="py-name">pysqlite2</tt> <tt class="py-keyword">import</tt> <tt class="py-name">dbapi2</tt> <tt class="py-keyword">as</tt> <tt class="py-name">sqlite</tt> </tt>
<a name="L733"></a><tt class="py-lineno">733</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-405" class="py-name"><a title="p4vasp.db.DBI.isConnected
p4vasp.db.DBIContainer.isConnected" class="py-name" href="#" onclick="return doclink('link-405', 'isConnected', 'link-118');">isConnected</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L734"></a><tt class="py-lineno">734</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-406" class="py-name"><a title="p4vasp.db.DBI.disconnect
p4vasp.db.DBIContainer.disconnect
p4vasp.db.MySQLDBI.disconnect
p4vasp.db.SQLiteDBI.disconnect" class="py-name" href="#" onclick="return doclink('link-406', 'disconnect', 'link-139');">disconnect</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L735"></a><tt class="py-lineno">735</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-407" class="py-name"><a title="p4vasp.db" class="py-name" href="#" onclick="return doclink('link-407', 'db', 'link-10');">db</a></tt><tt class="py-op">=</tt><tt class="py-name">sqlite</tt><tt class="py-op">.</tt><tt id="link-408" class="py-name"><a title="p4vasp.db.DBI.connect
p4vasp.db.DBIContainer.connect
p4vasp.db.MySQLDBI.connect
p4vasp.db.SQLiteDBI.connect" class="py-name" href="#" onclick="return doclink('link-408', 'connect', 'link-14');">connect</a></tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-409" class="py-name"><a title="p4vasp.Array.path
p4vasp.Dictionary.path
p4vasp.Structure.path
p4vasp.applet.Applet.path
p4vasp.message.path
p4vasp.repository.path
p4vasp.schedule'.path
p4vasp.store.path
p4vasp.util.path" class="py-name" href="#" onclick="return doclink('link-409', 'path', 'link-0');">path</a></tt><tt class="py-op">)</tt> </tt>
<a name="L736"></a><tt class="py-lineno">736</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-410" class="py-name"><a title="p4vasp.db.DBI.onConnect
p4vasp.db.UserManagementMixin.onConnect" class="py-name" href="#" onclick="return doclink('link-410', 'onConnect', 'link-24');">onConnect</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
</div><a name="L737"></a><tt class="py-lineno">737</tt>  <tt class="py-line"> </tt>
<a name="L738"></a><tt class="py-lineno">738</tt>  <tt class="py-line"> </tt>
<a name="SQLiteDBI.disconnect"></a><div id="SQLiteDBI.disconnect-def"><a name="L739"></a><tt class="py-lineno">739</tt> <a class="py-toggle" href="#" id="SQLiteDBI.disconnect-toggle" onclick="return toggle('SQLiteDBI.disconnect');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.SQLiteDBI-class.html#disconnect">disconnect</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="SQLiteDBI.disconnect-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="SQLiteDBI.disconnect-expanded"><a name="L740"></a><tt class="py-lineno">740</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-411" class="py-name"><a title="p4vasp.db" class="py-name" href="#" onclick="return doclink('link-411', 'db', 'link-10');">db</a></tt><tt class="py-op">=</tt><tt class="py-name">None</tt> </tt>
</div></div><a name="L741"></a><tt class="py-lineno">741</tt>  <tt class="py-line"> </tt>
<a name="L742"></a><tt class="py-lineno">742</tt>  <tt class="py-line"> </tt>
<a name="MySQLDBI"></a><div id="MySQLDBI-def"><a name="L743"></a><tt class="py-lineno">743</tt> <a class="py-toggle" href="#" id="MySQLDBI-toggle" onclick="return toggle('MySQLDBI');">-</a><tt class="py-line"><tt class="py-keyword">class</tt> <a class="py-def-name" href="p4vasp.db.MySQLDBI-class.html">MySQLDBI</a><tt class="py-op">(</tt><tt class="py-base-class">P4VMixin</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="MySQLDBI-collapsed" style="display:none;" pad="+++" indent="++++"></div><div id="MySQLDBI-expanded"><a name="MySQLDBI.__init__"></a><div id="MySQLDBI.__init__-def"><a name="L744"></a><tt class="py-lineno">744</tt> <a class="py-toggle" href="#" id="MySQLDBI.__init__-toggle" onclick="return toggle('MySQLDBI.__init__');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.MySQLDBI-class.html#__init__">__init__</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">user</tt><tt class="py-op">=</tt><tt class="py-name">None</tt><tt class="py-op">,</tt><tt class="py-param">password</tt><tt class="py-op">=</tt><tt class="py-name">None</tt><tt class="py-op">,</tt><tt class="py-param">host</tt><tt class="py-op">=</tt><tt class="py-name">None</tt><tt class="py-op">,</tt><tt class="py-param">database</tt><tt class="py-op">=</tt><tt class="py-name">None</tt><tt class="py-op">,</tt><tt class="py-param">connect</tt><tt class="py-op">=</tt><tt class="py-number">1</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="MySQLDBI.__init__-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="MySQLDBI.__init__-expanded"><a name="L745"></a><tt class="py-lineno">745</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">user</tt>     <tt class="py-op">=</tt> <tt class="py-name">user</tt> </tt>
<a name="L746"></a><tt class="py-lineno">746</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">password</tt> <tt class="py-op">=</tt> <tt class="py-name">password</tt> </tt>
<a name="L747"></a><tt class="py-lineno">747</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">host</tt>     <tt class="py-op">=</tt> <tt class="py-name">host</tt> </tt>
<a name="L748"></a><tt class="py-lineno">748</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">database</tt> <tt class="py-op">=</tt> <tt class="py-name">database</tt> </tt>
<a name="L749"></a><tt class="py-lineno">749</tt>  <tt class="py-line"> </tt>
<a name="L750"></a><tt class="py-lineno">750</tt>  <tt class="py-line">        <tt id="link-412" class="py-name"><a title="p4vasp.db.DBI" class="py-name" href="#" onclick="return doclink('link-412', 'DBI', 'link-380');">DBI</a></tt><tt class="py-op">.</tt><tt id="link-413" class="py-name"><a title="p4vasp.Array.Array.__init__
p4vasp.Array.ArrayRecord.__init__
p4vasp.Array.LateList.__init__
p4vasp.Array.SetLateList.__init__
p4vasp.Array.VArray.__init__
p4vasp.Array.rRecordSetLateList.__init__
p4vasp.Array.rcRecordSetLateList.__init__
p4vasp.ConvexShape.ConvexShape.__init__
p4vasp.Dictionary.Dictionary.__init__
p4vasp.Dictionary.Incar.__init__
p4vasp.Dictionary.StructuredDictionary.__init__
p4vasp.FArray.FArray1D.__init__
p4vasp.FArray.FArray2D.__init__
p4vasp.GraphCanvas.Export.__init__
p4vasp.GraphCanvas.GraphCanvas.__init__
p4vasp.GraphCanvas.GraphCanvasWindow.__init__
p4vasp.GraphCanvas_gtk1.Export.__init__
p4vasp.GraphCanvas_gtk1.GraphCanvas.__init__
p4vasp.GraphCanvas_gtk1.GraphCanvasWindow.__init__
p4vasp.GraphPM.GraphPM.__init__
p4vasp.GraphPM.GraphProperty.__init__
p4vasp.ODPdom.Attr.__init__
p4vasp.ODPdom.AttributeList.__init__
p4vasp.ODPdom.CharacterData.__init__
p4vasp.ODPdom.ChildrenByTagNameList.__init__
p4vasp.ODPdom.DOMException.__init__
p4vasp.ODPdom.Document.__init__
p4vasp.ODPdom.Element.__init__
p4vasp.ODPdom.NamedNodeMap.__init__
p4vasp.ODPdom.Node.__init__
p4vasp.ODPdom.NodeList.__init__
p4vasp.ODPdom.ProcessingInstruction.__init__
p4vasp.Property.FilterPropertyManager.__init__
p4vasp.Property.Property.__init__
p4vasp.Property.PropertyManager.__init__
p4vasp.SQLSystemPM.SQLForcesSequenceLateList.__init__
p4vasp.SQLSystemPM.SQLStructuresLL.__init__
p4vasp.SQLSystemPM.SQLSystemPM.__init__
p4vasp.Selection.Selection.__init__
p4vasp.Structure.AtomInfo.__init__
p4vasp.Structure.AtomtypesArray.__init__
p4vasp.Structure.AtomtypesRecord.__init__
p4vasp.Structure.Structure.__init__
p4vasp.StructureWindow.StructureWindow.__init__
p4vasp.SystemPM.ChgcarStatisticsLateList.__init__
p4vasp.SystemPM.KpointGeneration.__init__
p4vasp.SystemPM.KpointList.__init__
p4vasp.SystemPM.Kpoints.__init__
p4vasp.SystemPM.OldSystemPM.__init__
p4vasp.SystemPM.PoscarSystemPM.__init__
p4vasp.SystemPM.SetupPM.__init__
p4vasp.SystemPM.StructureSequenceLateList.__init__
p4vasp.SystemPM.SystemPM.__init__
p4vasp.SystemPM.SystemPM_URL_Attribute.__init__
p4vasp.SystemPM.SystemRepository.__init__
p4vasp.SystemPM.XMLSystemPM.__init__
p4vasp.SystemPM.cStructureSequenceLateList.__init__
p4vasp.applet.Applet.Applet.__init__
p4vasp.applet.Applet.AppletProfile.__init__
p4vasp.applet.Applet.GraphApplet.__init__
p4vasp.applet.Applet.TextApplet.__init__
p4vasp.applet.Applet.Widgets.__init__
p4vasp.applet.AppletRepositoryProfile.__init__
p4vasp.applet.AppletTree.AppletNode.__init__
p4vasp.applet.AppletTree.AppletTree.__init__
p4vasp.applet.AppletTree.AppletTreeModel.__init__
p4vasp.applet.AppletTree.AppletTreeStoreProfile.__init__
p4vasp.applet.AppletTree_old.AppletNode.__init__
p4vasp.applet.AppletTree_old.AppletTree.__init__
p4vasp.applet.AppletTree_old.AppletTreeStoreProfile.__init__
p4vasp.applet.BuilderApplet.BuilderApplet.__init__
p4vasp.applet.BuilderApplet.StructureTreeModel.__init__
p4vasp.applet.CommitApplet.CommitApplet.__init__
p4vasp.applet.DBApplet.DBApplet.__init__
p4vasp.applet.DBApplet.QueryTreeModel.__init__
p4vasp.applet.DielectricApplet.DielectricApplet.__init__
p4vasp.applet.EditSubZMatApplet.EditSubZMatApplet.__init__
p4vasp.applet.ElectronicApplet.ElectronicApplet.__init__
p4vasp.applet.ElectronicApplet.Line.__init__
p4vasp.applet.ElectronicControlApplet.ElectronicControlApplet.__init__
p4vasp.applet.EnergyConvergenceApplet.EnergyConvergenceApplet.__init__
p4vasp.applet.ExportApplet.ExportApplet.__init__
p4vasp.applet.ForcesConvergenceApplet.ForcesConvergenceApplet.__init__
p4vasp.applet.GraphWindowApplet.GraphWindowApplet.__init__
p4vasp.applet.InfoApplet.InfoApplet.__init__
p4vasp.applet.KpointsViewerApplet.KpointsViewerApplet.__init__
p4vasp.applet.LatticeApplet.LatticeApplet.__init__
p4vasp.applet.LocalPotentialApplet.LocalPotentialApplet.__init__
p4vasp.applet.MeasureApplet.DistanceTreeModel.__init__
p4vasp.applet.MeasureApplet.MeasureApplet.__init__
p4vasp.applet.MoveApplet.MoveApplet.__init__
p4vasp.applet.MultiplyCellApplet.MultiplyCellApplet.__init__
p4vasp.applet.NewApplet.NewApplet.__init__
p4vasp.applet.RotateApplet.RotateApplet.__init__
p4vasp.applet.STMWindowApplet.STMWindowApplet.__init__
p4vasp.applet.STMWindowControlApplet.STMWindowControlApplet.__init__
p4vasp.applet.SelForcesConvergenceApplet.SelForcesConvergenceApplet.__init__
p4vasp.applet.SelectionApplet.SelectionApplet.__init__
p4vasp.applet.ShowHideControlApplet.ShowHideControlApplet.__init__
p4vasp.applet.StructureApplet.Measure.__init__
p4vasp.applet.StructureApplet.StructureApplet.__init__
p4vasp.applet.StructureApplet.SubtrSequence.__init__
p4vasp.applet.StructureWindowApplet.StructureWindowApplet.__init__
p4vasp.applet.StructureWindowControlApplet.StructureWindowControlApplet.__init__
p4vasp.applet.StructureWindowControlApplet.SubtrSequence.__init__
p4vasp.applet.VACApplet.VACApplet.__init__
p4vasp.cStructure.AtomInfo.__init__
p4vasp.cStructure.AtomtypesRecord.__init__
p4vasp.cStructure.SelectiveArrayItemWrapper.__init__
p4vasp.cStructure.SelectiveArrayWrapper.__init__
p4vasp.cStructure.Structure.__init__
p4vasp.cmatrix.Matrix.__init__
p4vasp.cmatrix.Vector.__init__
p4vasp.db.DBI.__init__
p4vasp.db.MySQLDBI.__init__
p4vasp.db.Query.__init__
p4vasp.db.SQLiteDBI.__init__
p4vasp.graph.Axis.__init__
p4vasp.graph.Graph.__init__
p4vasp.graph.GraphLine.__init__
p4vasp.graph.Set.__init__
p4vasp.graph.World.__init__
p4vasp.graph.XAxis.__init__
p4vasp.graph.YAxis.__init__
p4vasp.matrix.Matrix.__init__
p4vasp.matrix.Vector.__init__
p4vasp.message.MessageDriver.__init__
p4vasp.paint3d.ColladaPaint3D.ColladaEffectsPaint3D.__init__
p4vasp.paint3d.ColladaPaint3D.ColladaGeometriesPaint3D.__init__
p4vasp.paint3d.ColladaPaint3D.ColladaPaint3D.__init__
p4vasp.paint3d.ColladaPaint3D.ColladaScenePaint3D.__init__
p4vasp.paint3d.OpenGLPaint3D.BasicOpenGLPaint3D.__init__
p4vasp.paint3d.OpenGLPaint3D.GLUTPaint3D.__init__
p4vasp.paint3d.OpenGLPaint3D.OpenGLPaint3DFrame.__init__
p4vasp.paint3d.OpenGLPaint3D.OpenGLPaint3DRecorder.__init__
p4vasp.paint3d.Paint3DInterface.Paint3DInterface.__init__
p4vasp.paint3d.Paint3DInterface.Paint3DRecorder.__init__
p4vasp.paint3d.PovrayPaint3D.ExtendedPovrayPaint3D.__init__
p4vasp.paint3d.PovrayPaint3D.PovrayPaint3D.__init__
p4vasp.paint3d.PovrayPaint3D.PovrayPaint3DFrame.__init__
p4vasp.paint3d.data.AmbientLight.__init__
p4vasp.paint3d.data.Arrow.__init__
p4vasp.paint3d.data.Background.__init__
p4vasp.paint3d.data.ColorMaterial.__init__
p4vasp.paint3d.data.Cone.__init__
p4vasp.paint3d.data.Cylinder.__init__
p4vasp.paint3d.data.Frame.__init__
p4vasp.paint3d.data.Line.__init__
p4vasp.paint3d.data.Mesh.__init__
p4vasp.paint3d.data.OrthographicCamera.__init__
p4vasp.paint3d.data.PerspectiveCamera.__init__
p4vasp.paint3d.data.PointLight.__init__
p4vasp.paint3d.data.Sphere.__init__
p4vasp.repository.Descriptor.__init__
p4vasp.repository.DescriptorProfile.__init__
p4vasp.repository.Factory.__init__
p4vasp.repository.FactoryProfile.__init__
p4vasp.repository.Repository.__init__
p4vasp.repository.RepositoryProfile.__init__
p4vasp.schedule'.Scheduler.__init__
p4vasp.setupstore.SetupProfile.__init__
p4vasp.setupstore.SetupProfile_old.__init__
p4vasp.store.AttributeProfile.__init__
p4vasp.store.ClassAttribute.__init__
p4vasp.store.FloatAttribute.__init__
p4vasp.store.FloatListAttribute.__init__
p4vasp.store.FloatTupleAttribute.__init__
p4vasp.store.HexMarshalAttribute.__init__
p4vasp.store.HexPickleAttribute.__init__
p4vasp.store.IgnoreProfile.__init__
p4vasp.store.IntAttribute.__init__
p4vasp.store.IntListAttribute.__init__
p4vasp.store.IntTupleAttribute.__init__
p4vasp.store.ListAttribute.__init__
p4vasp.store.Profile.__init__
p4vasp.store.StringAttribute.__init__
p4vasp.store.StringListAttribute.__init__
p4vasp.util.ParseException.__init__
p4vasp.util.UnknownType.__init__
p4vasp.util.XMLParseException.__init__
p4vasp.uuid.UuidGen.__init__
p4vasp.uuid._GeneratorState.__init__" class="py-name" href="#" onclick="return doclink('link-413', '__init__', 'link-381');">__init__</a></tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">,</tt><tt id="link-414" class="py-name"><a title="p4vasp.db.DBI.connect
p4vasp.db.DBIContainer.connect
p4vasp.db.MySQLDBI.connect
p4vasp.db.SQLiteDBI.connect" class="py-name" href="#" onclick="return doclink('link-414', 'connect', 'link-14');">connect</a></tt><tt class="py-op">=</tt><tt id="link-415" class="py-name"><a title="p4vasp.db.DBI.connect
p4vasp.db.DBIContainer.connect
p4vasp.db.MySQLDBI.connect
p4vasp.db.SQLiteDBI.connect" class="py-name" href="#" onclick="return doclink('link-415', 'connect', 'link-14');">connect</a></tt><tt class="py-op">)</tt> </tt>
</div><a name="L751"></a><tt class="py-lineno">751</tt>  <tt class="py-line"> </tt>
<a name="MySQLDBI.config"></a><div id="MySQLDBI.config-def"><a name="L752"></a><tt class="py-lineno">752</tt> <a class="py-toggle" href="#" id="MySQLDBI.config-toggle" onclick="return toggle('MySQLDBI.config');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.MySQLDBI-class.html#config">config</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">,</tt><tt class="py-param">c</tt><tt class="py-op">,</tt><tt class="py-param">name</tt><tt class="py-op">=</tt><tt class="py-name">None</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="MySQLDBI.config-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="MySQLDBI.config-expanded"><a name="L753"></a><tt class="py-lineno">753</tt>  <tt class="py-line">        <tt class="py-name">cc</tt><tt class="py-op">=</tt><tt class="py-op">{</tt><tt class="py-op">}</tt> </tt>
<a name="L754"></a><tt class="py-lineno">754</tt>  <tt class="py-line">        <tt class="py-name">cc</tt><tt class="py-op">.</tt><tt id="link-416" class="py-name"><a title="p4vasp.Dictionary.StructuredDictionary.update
p4vasp.applet.Applet.GraphApplet.update
p4vasp.applet.ElectronicApplet.ElectronicApplet.update
p4vasp.applet.GraphWindowApplet.GraphWindowApplet.update" class="py-name" href="#" onclick="return doclink('link-416', 'update', 'link-21');">update</a></tt><tt class="py-op">(</tt><tt id="link-417" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-417', 'c', 'link-22');">c</a></tt><tt class="py-op">)</tt> </tt>
<a name="L755"></a><tt class="py-lineno">755</tt>  <tt class="py-line">        <tt id="link-418" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-418', 'c', 'link-22');">c</a></tt><tt class="py-op">=</tt><tt class="py-name">cc</tt> </tt>
<a name="L756"></a><tt class="py-lineno">756</tt>  <tt class="py-line">        <tt id="link-419" class="py-name"><a title="p4vasp.db.DBI" class="py-name" href="#" onclick="return doclink('link-419', 'DBI', 'link-380');">DBI</a></tt><tt class="py-op">.</tt><tt id="link-420" class="py-name"><a title="p4vasp.db.DBI.config
p4vasp.db.MySQLDBI.config
p4vasp.db.SQLiteDBI.config" class="py-name" href="#" onclick="return doclink('link-420', 'config', 'link-393');">config</a></tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">,</tt><tt id="link-421" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-421', 'c', 'link-22');">c</a></tt><tt class="py-op">,</tt><tt id="link-422" class="py-name"><a title="p4vasp.applet.Applet.Applet.name" class="py-name" href="#" onclick="return doclink('link-422', 'name', 'link-12');">name</a></tt><tt class="py-op">)</tt> </tt>
<a name="L757"></a><tt class="py-lineno">757</tt>  <tt class="py-line"> </tt>
<a name="L758"></a><tt class="py-lineno">758</tt>  <tt class="py-line">        <tt class="py-name">reconnect</tt><tt class="py-op">=</tt><tt class="py-number">0</tt> </tt>
<a name="L759"></a><tt class="py-lineno">759</tt>  <tt class="py-line">        <tt class="py-name">isconnected</tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-423" class="py-name"><a title="p4vasp.db.DBI.isConnected
p4vasp.db.DBIContainer.isConnected" class="py-name" href="#" onclick="return doclink('link-423', 'isConnected', 'link-118');">isConnected</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L760"></a><tt class="py-lineno">760</tt>  <tt class="py-line">        <tt class="py-keyword">for</tt> <tt class="py-name">key</tt> <tt class="py-keyword">in</tt> <tt class="py-op">[</tt><tt class="py-string">"user"</tt><tt class="py-op">,</tt><tt class="py-string">"password"</tt><tt class="py-op">,</tt><tt class="py-string">"host"</tt><tt class="py-op">,</tt><tt class="py-string">"database"</tt><tt class="py-op">]</tt><tt class="py-op">:</tt> </tt>
<a name="L761"></a><tt class="py-lineno">761</tt>  <tt class="py-line">            <tt class="py-keyword">if</tt> <tt id="link-424" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-424', 'c', 'link-22');">c</a></tt><tt class="py-op">.</tt><tt id="link-425" class="py-name"><a title="p4vasp.Dictionary.StructuredDictionary.has_key" class="py-name" href="#" onclick="return doclink('link-425', 'has_key', 'link-17');">has_key</a></tt><tt class="py-op">(</tt><tt class="py-string">"db_"</tt><tt class="py-op">+</tt><tt class="py-name">key</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L762"></a><tt class="py-lineno">762</tt>  <tt class="py-line">                <tt class="py-keyword">if</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-426" class="py-name"><a title="p4vasp.db.DBI.isConnected
p4vasp.db.DBIContainer.isConnected" class="py-name" href="#" onclick="return doclink('link-426', 'isConnected', 'link-118');">isConnected</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L763"></a><tt class="py-lineno">763</tt>  <tt class="py-line">                    <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-427" class="py-name"><a title="p4vasp.db.DBI.disconnect
p4vasp.db.DBIContainer.disconnect
p4vasp.db.MySQLDBI.disconnect
p4vasp.db.SQLiteDBI.disconnect" class="py-name" href="#" onclick="return doclink('link-427', 'disconnect', 'link-139');">disconnect</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L764"></a><tt class="py-lineno">764</tt>  <tt class="py-line">                <tt class="py-name">setattr</tt><tt class="py-op">(</tt><tt class="py-name">self</tt><tt class="py-op">,</tt><tt class="py-name">key</tt><tt class="py-op">,</tt><tt id="link-428" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-428', 'c', 'link-22');">c</a></tt><tt class="py-op">[</tt><tt class="py-string">"db_"</tt><tt class="py-op">+</tt><tt class="py-name">key</tt><tt class="py-op">]</tt><tt class="py-op">)</tt> </tt>
<a name="L765"></a><tt class="py-lineno">765</tt>  <tt class="py-line">                <tt class="py-name">reconnect</tt><tt class="py-op">=</tt><tt class="py-number">1</tt> </tt>
<a name="L766"></a><tt class="py-lineno">766</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt class="py-name">reconnect</tt> <tt class="py-keyword">and</tt> <tt class="py-name">isconnected</tt><tt class="py-op">:</tt> </tt>
<a name="L767"></a><tt class="py-lineno">767</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-429" class="py-name"><a title="p4vasp.db.DBI.connect
p4vasp.db.DBIContainer.connect
p4vasp.db.MySQLDBI.connect
p4vasp.db.SQLiteDBI.connect" class="py-name" href="#" onclick="return doclink('link-429', 'connect', 'link-14');">connect</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
</div><a name="L768"></a><tt class="py-lineno">768</tt>  <tt class="py-line"> </tt>
<a name="MySQLDBI.connect"></a><div id="MySQLDBI.connect-def"><a name="L769"></a><tt class="py-lineno">769</tt> <a class="py-toggle" href="#" id="MySQLDBI.connect-toggle" onclick="return toggle('MySQLDBI.connect');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.MySQLDBI-class.html#connect">connect</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="MySQLDBI.connect-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="MySQLDBI.connect-expanded"><a name="L770"></a><tt class="py-lineno">770</tt>  <tt class="py-line">        <tt class="py-keyword">import</tt> <tt class="py-name">MySQLdb</tt> <tt class="py-keyword">as</tt> <tt class="py-name">mysql</tt> </tt>
<a name="L771"></a><tt class="py-lineno">771</tt>  <tt class="py-line">        <tt class="py-keyword">if</tt> <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-430" class="py-name"><a title="p4vasp.db.DBI.isConnected
p4vasp.db.DBIContainer.isConnected" class="py-name" href="#" onclick="return doclink('link-430', 'isConnected', 'link-118');">isConnected</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L772"></a><tt class="py-lineno">772</tt>  <tt class="py-line">            <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-431" class="py-name"><a title="p4vasp.db.DBI.disconnect
p4vasp.db.DBIContainer.disconnect
p4vasp.db.MySQLDBI.disconnect
p4vasp.db.SQLiteDBI.disconnect" class="py-name" href="#" onclick="return doclink('link-431', 'disconnect', 'link-139');">disconnect</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L773"></a><tt class="py-lineno">773</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-432" class="py-name"><a title="p4vasp.db" class="py-name" href="#" onclick="return doclink('link-432', 'db', 'link-10');">db</a></tt><tt class="py-op">=</tt><tt class="py-name">mysql</tt><tt class="py-op">.</tt><tt id="link-433" class="py-name"><a title="p4vasp.db.DBI.connect
p4vasp.db.DBIContainer.connect
p4vasp.db.MySQLDBI.connect
p4vasp.db.SQLiteDBI.connect" class="py-name" href="#" onclick="return doclink('link-433', 'connect', 'link-14');">connect</a></tt><tt class="py-op">(</tt><tt class="py-name">host</tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">host</tt><tt class="py-op">,</tt><tt class="py-name">user</tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">user</tt><tt class="py-op">,</tt><tt id="link-434" class="py-name"><a title="p4vasp.db" class="py-name" href="#" onclick="return doclink('link-434', 'db', 'link-10');">db</a></tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">database</tt><tt class="py-op">,</tt><tt class="py-name">passwd</tt><tt class="py-op">=</tt><tt class="py-name">self</tt><tt class="py-op">.</tt><tt class="py-name">password</tt><tt class="py-op">)</tt> </tt>
<a name="L774"></a><tt class="py-lineno">774</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-435" class="py-name"><a title="p4vasp.db.DBI.onConnect
p4vasp.db.UserManagementMixin.onConnect" class="py-name" href="#" onclick="return doclink('link-435', 'onConnect', 'link-24');">onConnect</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
</div><a name="L775"></a><tt class="py-lineno">775</tt>  <tt class="py-line"> </tt>
<a name="L776"></a><tt class="py-lineno">776</tt>  <tt class="py-line"> </tt>
<a name="MySQLDBI.commit"></a><div id="MySQLDBI.commit-def"><a name="L777"></a><tt class="py-lineno">777</tt> <a class="py-toggle" href="#" id="MySQLDBI.commit-toggle" onclick="return toggle('MySQLDBI.commit');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.MySQLDBI-class.html#commit">commit</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="MySQLDBI.commit-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="MySQLDBI.commit-expanded"><a name="L778"></a><tt class="py-lineno">778</tt>  <tt class="py-line">        <tt class="py-keyword">pass</tt> </tt>
</div><a name="L779"></a><tt class="py-lineno">779</tt>  <tt class="py-line"> </tt>
<a name="MySQLDBI.disconnect"></a><div id="MySQLDBI.disconnect-def"><a name="L780"></a><tt class="py-lineno">780</tt> <a class="py-toggle" href="#" id="MySQLDBI.disconnect-toggle" onclick="return toggle('MySQLDBI.disconnect');">-</a><tt class="py-line">    <tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db.MySQLDBI-class.html#disconnect">disconnect</a><tt class="py-op">(</tt><tt class="py-param">self</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="MySQLDBI.disconnect-collapsed" style="display:none;" pad="+++" indent="++++++++"></div><div id="MySQLDBI.disconnect-expanded"><a name="L781"></a><tt class="py-lineno">781</tt>  <tt class="py-line">        <tt class="py-name">self</tt><tt class="py-op">.</tt><tt id="link-436" class="py-name"><a title="p4vasp.db" class="py-name" href="#" onclick="return doclink('link-436', 'db', 'link-10');">db</a></tt><tt class="py-op">=</tt><tt class="py-name">None</tt> </tt>
</div></div><a name="L782"></a><tt class="py-lineno">782</tt>  <tt class="py-line"> </tt>
<a name="createFromConfig"></a><div id="createFromConfig-def"><a name="L783"></a><tt class="py-lineno">783</tt> <a class="py-toggle" href="#" id="createFromConfig-toggle" onclick="return toggle('createFromConfig');">-</a><tt class="py-line"><tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db-module.html#createFromConfig">createFromConfig</a><tt class="py-op">(</tt><tt class="py-param">l</tt><tt class="py-op">,</tt><tt class="py-param">prototypes</tt><tt class="py-op">=</tt><tt class="py-op">{</tt><tt class="py-string">"sqlite"</tt><tt class="py-op">:</tt><tt id="link-437" class="py-name" targets="Class p4vasp.db.SQLiteDBI=p4vasp.db.SQLiteDBI-class.html"><a title="p4vasp.db.SQLiteDBI" class="py-name" href="#" onclick="return doclink('link-437', 'SQLiteDBI', 'link-437');">SQLiteDBI</a></tt><tt class="py-op">,</tt><tt class="py-string">"mysql"</tt><tt class="py-op">:</tt><tt id="link-438" class="py-name" targets="Class p4vasp.db.MySQLDBI=p4vasp.db.MySQLDBI-class.html"><a title="p4vasp.db.MySQLDBI" class="py-name" href="#" onclick="return doclink('link-438', 'MySQLDBI', 'link-438');">MySQLDBI</a></tt><tt class="py-op">}</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="createFromConfig-collapsed" style="display:none;" pad="+++" indent="++++"></div><div id="createFromConfig-expanded"><a name="L784"></a><tt class="py-lineno">784</tt>  <tt class="py-line">    <tt class="py-keyword">import</tt> <tt class="py-name">os</tt><tt class="py-op">.</tt><tt id="link-439" class="py-name"><a title="p4vasp.Array.path
p4vasp.Dictionary.path
p4vasp.Structure.path
p4vasp.applet.Applet.path
p4vasp.message.path
p4vasp.repository.path
p4vasp.schedule'.path
p4vasp.store.path
p4vasp.util.path" class="py-name" href="#" onclick="return doclink('link-439', 'path', 'link-0');">path</a></tt> </tt>
<a name="L785"></a><tt class="py-lineno">785</tt>  <tt class="py-line">    <tt class="py-keyword">import</tt> <tt class="py-name">getpass</tt> </tt>
<a name="L786"></a><tt class="py-lineno">786</tt>  <tt class="py-line">    <tt class="py-name">defaults</tt><tt class="py-op">=</tt><tt class="py-op">{</tt><tt class="py-op">}</tt> </tt>
<a name="L787"></a><tt class="py-lineno">787</tt>  <tt class="py-line">    <tt class="py-name">defaults</tt><tt class="py-op">[</tt><tt class="py-string">"home"</tt><tt class="py-op">]</tt><tt class="py-op">=</tt><tt class="py-name">os</tt><tt class="py-op">.</tt><tt id="link-440" class="py-name"><a title="p4vasp.Array.path
p4vasp.Dictionary.path
p4vasp.Structure.path
p4vasp.applet.Applet.path
p4vasp.message.path
p4vasp.repository.path
p4vasp.schedule'.path
p4vasp.store.path
p4vasp.util.path" class="py-name" href="#" onclick="return doclink('link-440', 'path', 'link-0');">path</a></tt><tt class="py-op">.</tt><tt class="py-name">expanduser</tt><tt class="py-op">(</tt><tt class="py-string">"~"</tt><tt class="py-op">)</tt> </tt>
<a name="L788"></a><tt class="py-lineno">788</tt>  <tt class="py-line">    <tt class="py-name">defaults</tt><tt class="py-op">[</tt><tt class="py-string">"user"</tt><tt class="py-op">]</tt><tt class="py-op">=</tt><tt class="py-name">getpass</tt><tt class="py-op">.</tt><tt class="py-name">getuser</tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L789"></a><tt class="py-lineno">789</tt>  <tt class="py-line">    <tt id="link-441" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-441', 'c', 'link-22');">c</a></tt><tt class="py-op">=</tt><tt class="py-name">ConfigParser</tt><tt class="py-op">(</tt><tt class="py-name">defaults</tt><tt class="py-op">)</tt> </tt>
<a name="L790"></a><tt class="py-lineno">790</tt>  <tt class="py-line">    <tt id="link-442" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-442', 'c', 'link-22');">c</a></tt><tt class="py-op">.</tt><tt id="link-443" class="py-name"><a title="p4vasp.Dictionary.Incar.read
p4vasp.GraphPM.GraphProperty.read
p4vasp.Property.Property.read
p4vasp.Structure.Structure.read
p4vasp.cStructure.Structure.read
p4vasp.util.Parseable.read" class="py-name" href="#" onclick="return doclink('link-443', 'read', 'link-59');">read</a></tt><tt class="py-op">(</tt><tt class="py-name">l</tt><tt class="py-op">)</tt> </tt>
<a name="L791"></a><tt class="py-lineno">791</tt>  <tt class="py-line"><tt class="py-comment">#  c.write(open("out","w"))</tt> </tt>
<a name="L792"></a><tt class="py-lineno">792</tt>  <tt class="py-line">    <tt class="py-name">cont</tt><tt class="py-op">=</tt><tt id="link-444" class="py-name" targets="Class p4vasp.db.DBIContainer=p4vasp.db.DBIContainer-class.html"><a title="p4vasp.db.DBIContainer" class="py-name" href="#" onclick="return doclink('link-444', 'DBIContainer', 'link-444');">DBIContainer</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L793"></a><tt class="py-lineno">793</tt>  <tt class="py-line">    <tt class="py-keyword">for</tt> <tt class="py-name">s</tt> <tt class="py-keyword">in</tt> <tt id="link-445" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-445', 'c', 'link-22');">c</a></tt><tt class="py-op">.</tt><tt class="py-name">sections</tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L794"></a><tt class="py-lineno">794</tt>  <tt class="py-line"><tt class="py-comment">#    try:</tt> </tt>
<a name="L795"></a><tt class="py-lineno">795</tt>  <tt class="py-line">        <tt class="py-name">t</tt><tt class="py-op">=</tt><tt class="py-name">lower</tt><tt class="py-op">(</tt><tt id="link-446" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-446', 'c', 'link-22');">c</a></tt><tt class="py-op">.</tt><tt id="link-447" class="py-name"><a title="p4vasp.ODPdom.AttributeList.get
p4vasp.ODPdom.NamedNodeMap.get
p4vasp.Property.Property.get
p4vasp.cStructure.Structure.get
p4vasp.cmatrix.Matrix.get
p4vasp.cmatrix.Vector.get
p4vasp.db.Query.get
p4vasp.matrix.Matrix.get
p4vasp.matrix.Vector.get
p4vasp.paint3d.Paint3DInterface.Paint3DRecorder.get" class="py-name" href="#" onclick="return doclink('link-447', 'get', 'link-115');">get</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">,</tt><tt class="py-string">"type"</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L796"></a><tt class="py-lineno">796</tt>  <tt class="py-line">        <tt class="py-keyword">print</tt> <tt class="py-string">"CREATE"</tt><tt class="py-op">,</tt><tt class="py-name">s</tt><tt class="py-op">,</tt><tt class="py-name">t</tt> </tt>
<a name="L797"></a><tt class="py-lineno">797</tt>  <tt class="py-line"><tt class="py-comment">#    except:</tt> </tt>
<a name="L798"></a><tt class="py-lineno">798</tt>  <tt class="py-line"><tt class="py-comment">#      print "Section %s - type missing"%s</tt> </tt>
<a name="L799"></a><tt class="py-lineno">799</tt>  <tt class="py-line"><tt class="py-comment">#      continue</tt> </tt>
<a name="L800"></a><tt class="py-lineno">800</tt>  <tt class="py-line"><tt class="py-comment">#    try:</tt> </tt>
<a name="L801"></a><tt class="py-lineno">801</tt>  <tt class="py-line">        <tt id="link-448" class="py-name"><a title="p4vasp.db.DBI" class="py-name" href="#" onclick="return doclink('link-448', 'DBI', 'link-380');">DBI</a></tt><tt class="py-op">=</tt><tt class="py-name">prototypes</tt><tt class="py-op">[</tt><tt class="py-name">t</tt><tt class="py-op">]</tt> </tt>
<a name="L802"></a><tt class="py-lineno">802</tt>  <tt class="py-line"> </tt>
<a name="L803"></a><tt class="py-lineno">803</tt>  <tt class="py-line">        <tt class="py-name">d</tt><tt class="py-op">=</tt><tt id="link-449" class="py-name"><a title="p4vasp.db.DBI" class="py-name" href="#" onclick="return doclink('link-449', 'DBI', 'link-380');">DBI</a></tt><tt class="py-op">(</tt><tt id="link-450" class="py-name"><a title="p4vasp.db.DBI.connect
p4vasp.db.DBIContainer.connect
p4vasp.db.MySQLDBI.connect
p4vasp.db.SQLiteDBI.connect" class="py-name" href="#" onclick="return doclink('link-450', 'connect', 'link-14');">connect</a></tt><tt class="py-op">=</tt><tt class="py-number">0</tt><tt class="py-op">)</tt> </tt>
<a name="L804"></a><tt class="py-lineno">804</tt>  <tt class="py-line"> </tt>
<a name="L805"></a><tt class="py-lineno">805</tt>  <tt class="py-line"><tt class="py-comment">#    except:</tt> </tt>
<a name="L806"></a><tt class="py-lineno">806</tt>  <tt class="py-line"><tt class="py-comment">#      print "Section %s - unsupported type %s"%(s,t)</tt> </tt>
<a name="L807"></a><tt class="py-lineno">807</tt>  <tt class="py-line"><tt class="py-comment">#      continue</tt> </tt>
<a name="L808"></a><tt class="py-lineno">808</tt>  <tt class="py-line"><tt class="py-comment">#    try:</tt> </tt>
<a name="L809"></a><tt class="py-lineno">809</tt>  <tt class="py-line"><tt class="py-comment">#      print "config",c</tt> </tt>
<a name="L810"></a><tt class="py-lineno">810</tt>  <tt class="py-line">        <tt class="py-name">d</tt><tt class="py-op">.</tt><tt id="link-451" class="py-name"><a title="p4vasp.db.DBI.config
p4vasp.db.MySQLDBI.config
p4vasp.db.SQLiteDBI.config" class="py-name" href="#" onclick="return doclink('link-451', 'config', 'link-393');">config</a></tt><tt class="py-op">(</tt><tt class="py-name">dict</tt><tt class="py-op">(</tt><tt id="link-452" class="py-name"><a title="p4vasp.SystemPM.c" class="py-name" href="#" onclick="return doclink('link-452', 'c', 'link-22');">c</a></tt><tt class="py-op">.</tt><tt id="link-453" class="py-name"><a title="p4vasp.Dictionary.StructuredDictionary.items
p4vasp.ODPdom.AttributeList.items
p4vasp.ODPdom.NamedNodeMap.items" class="py-name" href="#" onclick="return doclink('link-453', 'items', 'link-23');">items</a></tt><tt class="py-op">(</tt><tt class="py-name">s</tt><tt class="py-op">)</tt><tt class="py-op">)</tt><tt class="py-op">,</tt><tt class="py-name">s</tt><tt class="py-op">)</tt> </tt>
<a name="L811"></a><tt class="py-lineno">811</tt>  <tt class="py-line"><tt class="py-comment">#    except:</tt> </tt>
<a name="L812"></a><tt class="py-lineno">812</tt>  <tt class="py-line"><tt class="py-comment">#      print "Section %s - configuration failed"%(s)</tt> </tt>
<a name="L813"></a><tt class="py-lineno">813</tt>  <tt class="py-line"><tt class="py-comment">#      continue</tt> </tt>
<a name="L814"></a><tt class="py-lineno">814</tt>  <tt class="py-line">        <tt class="py-name">cont</tt><tt class="py-op">.</tt><tt id="link-454" class="py-name"><a title="p4vasp.Structure.AtomInfo.append
p4vasp.Structure.Structure.append
p4vasp.cStructure.AtomInfo.append
p4vasp.cStructure.Structure.append
p4vasp.graph.Graph.append
p4vasp.graph.World.append
p4vasp.repository.Repository.append" class="py-name" href="#" onclick="return doclink('link-454', 'append', 'link-84');">append</a></tt><tt class="py-op">(</tt><tt class="py-name">d</tt><tt class="py-op">)</tt> </tt>
<a name="L815"></a><tt class="py-lineno">815</tt>  <tt class="py-line">    <tt class="py-keyword">return</tt> <tt class="py-name">cont</tt> </tt>
</div><a name="L816"></a><tt class="py-lineno">816</tt>  <tt class="py-line"> </tt>
<a name="L817"></a><tt class="py-lineno">817</tt>  <tt class="py-line"> </tt>
<a name="L818"></a><tt class="py-lineno">818</tt>  <tt class="py-line"><tt id="link-455" class="py-name" targets="Variable p4vasp.db._currentDBI=p4vasp.db-module.html#_currentDBI"><a title="p4vasp.db._currentDBI" class="py-name" href="#" onclick="return doclink('link-455', '_currentDBI', 'link-455');">_currentDBI</a></tt><tt class="py-op">=</tt><tt class="py-name">None</tt> </tt>
<a name="L819"></a><tt class="py-lineno">819</tt>  <tt class="py-line"> </tt>
<a name="getDatabase"></a><div id="getDatabase-def"><a name="L820"></a><tt class="py-lineno">820</tt> <a class="py-toggle" href="#" id="getDatabase-toggle" onclick="return toggle('getDatabase');">-</a><tt class="py-line"><tt class="py-keyword">def</tt> <a class="py-def-name" href="p4vasp.db-module.html#getDatabase">getDatabase</a><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
</div><div id="getDatabase-collapsed" style="display:none;" pad="+++" indent="++++"></div><div id="getDatabase-expanded"><a name="L821"></a><tt class="py-lineno">821</tt>  <tt class="py-line">    <tt class="py-keyword">from</tt> <tt id="link-456" class="py-name"><a title="p4vasp" class="py-name" href="#" onclick="return doclink('link-456', 'p4vasp', 'link-1');">p4vasp</a></tt><tt class="py-op">.</tt><tt id="link-457" class="py-name" targets="Module p4vasp.uuid=p4vasp.uuid-module.html"><a title="p4vasp.uuid" class="py-name" href="#" onclick="return doclink('link-457', 'uuid', 'link-457');">uuid</a></tt> <tt class="py-keyword">import</tt> <tt id="link-458" class="py-name" targets="Method p4vasp.uuid.UuidGen.uuid_random()=p4vasp.uuid.UuidGen-class.html#uuid_random,Function p4vasp.uuid.uuid_random()=p4vasp.uuid-module.html#uuid_random"><a title="p4vasp.uuid.UuidGen.uuid_random
p4vasp.uuid.uuid_random" class="py-name" href="#" onclick="return doclink('link-458', 'uuid_random', 'link-458');">uuid_random</a></tt> <tt class="py-keyword">as</tt> <tt id="link-459" class="py-name"><a title="p4vasp.uuid" class="py-name" href="#" onclick="return doclink('link-459', 'uuid', 'link-457');">uuid</a></tt> </tt>
<a name="L822"></a><tt class="py-lineno">822</tt>  <tt class="py-line">    <tt class="py-keyword">from</tt> <tt class="py-name">getpass</tt> <tt class="py-keyword">import</tt> <tt class="py-name">getuser</tt> </tt>
<a name="L823"></a><tt class="py-lineno">823</tt>  <tt class="py-line">    <tt class="py-keyword">global</tt> <tt id="link-460" class="py-name"><a title="p4vasp.db._currentDBI" class="py-name" href="#" onclick="return doclink('link-460', '_currentDBI', 'link-455');">_currentDBI</a></tt> </tt>
<a name="L824"></a><tt class="py-lineno">824</tt>  <tt class="py-line"> </tt>
<a name="L825"></a><tt class="py-lineno">825</tt>  <tt class="py-line">    <tt class="py-keyword">if</tt> <tt id="link-461" class="py-name"><a title="p4vasp.db._currentDBI" class="py-name" href="#" onclick="return doclink('link-461', '_currentDBI', 'link-455');">_currentDBI</a></tt> <tt class="py-keyword">is</tt> <tt class="py-keyword">not</tt> <tt class="py-name">None</tt> <tt class="py-keyword">and</tt> <tt class="py-name">type</tt><tt class="py-op">(</tt><tt id="link-462" class="py-name"><a title="p4vasp.db._currentDBI" class="py-name" href="#" onclick="return doclink('link-462', '_currentDBI', 'link-455');">_currentDBI</a></tt><tt class="py-op">)</tt> <tt class="py-op">!=</tt> <tt class="py-name">type</tt><tt class="py-op">(</tt><tt class="py-string">""</tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L826"></a><tt class="py-lineno">826</tt>  <tt class="py-line">        <tt class="py-keyword">for</tt> <tt class="py-name">x</tt> <tt class="py-keyword">in</tt> <tt id="link-463" class="py-name"><a title="p4vasp.db._currentDBI" class="py-name" href="#" onclick="return doclink('link-463', '_currentDBI', 'link-455');">_currentDBI</a></tt><tt class="py-op">:</tt> </tt>
<a name="L827"></a><tt class="py-lineno">827</tt>  <tt class="py-line">            <tt class="py-keyword">print</tt> <tt class="py-string">"DBI:::::::::::::"</tt><tt class="py-op">,</tt><tt class="py-name">x</tt><tt class="py-op">.</tt><tt class="py-name">__class__</tt><tt class="py-op">.</tt><tt class="py-name">__name__</tt><tt class="py-op">,</tt><tt class="py-name">x</tt><tt class="py-op">.</tt><tt id="link-464" class="py-name"><a title="p4vasp.applet.Applet.Applet.name" class="py-name" href="#" onclick="return doclink('link-464', 'name', 'link-12');">name</a></tt> </tt>
<a name="L828"></a><tt class="py-lineno">828</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt id="link-465" class="py-name"><a title="p4vasp.db._currentDBI" class="py-name" href="#" onclick="return doclink('link-465', '_currentDBI', 'link-455');">_currentDBI</a></tt> </tt>
<a name="L829"></a><tt class="py-lineno">829</tt>  <tt class="py-line"> </tt>
<a name="L830"></a><tt class="py-lineno">830</tt>  <tt class="py-line"> </tt>
<a name="L831"></a><tt class="py-lineno">831</tt>  <tt class="py-line">    <tt id="link-466" class="py-name"><a title="p4vasp.db._currentDBI" class="py-name" href="#" onclick="return doclink('link-466', '_currentDBI', 'link-455');">_currentDBI</a></tt><tt class="py-op">=</tt><tt class="py-name">os</tt><tt class="py-op">.</tt><tt id="link-467" class="py-name"><a title="p4vasp.Array.path
p4vasp.Dictionary.path
p4vasp.Structure.path
p4vasp.applet.Applet.path
p4vasp.message.path
p4vasp.repository.path
p4vasp.schedule'.path
p4vasp.store.path
p4vasp.util.path" class="py-name" href="#" onclick="return doclink('link-467', 'path', 'link-0');">path</a></tt><tt class="py-op">.</tt><tt class="py-name">join</tt><tt class="py-op">(</tt><tt id="link-468" class="py-name" targets="Function p4vasp.getUserConfigurationDirectory()=p4vasp-module.html#getUserConfigurationDirectory"><a title="p4vasp.getUserConfigurationDirectory" class="py-name" href="#" onclick="return doclink('link-468', 'getUserConfigurationDirectory', 'link-468');">getUserConfigurationDirectory</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">,</tt><tt class="py-string">"database.cfg"</tt><tt class="py-op">)</tt> </tt>
<a name="L832"></a><tt class="py-lineno">832</tt>  <tt class="py-line"> </tt>
<a name="L833"></a><tt class="py-lineno">833</tt>  <tt class="py-line">    <tt class="py-keyword">if</tt> <tt class="py-name">os</tt><tt class="py-op">.</tt><tt id="link-469" class="py-name"><a title="p4vasp.Array.path
p4vasp.Dictionary.path
p4vasp.Structure.path
p4vasp.applet.Applet.path
p4vasp.message.path
p4vasp.repository.path
p4vasp.schedule'.path
p4vasp.store.path
p4vasp.util.path" class="py-name" href="#" onclick="return doclink('link-469', 'path', 'link-0');">path</a></tt><tt class="py-op">.</tt><tt class="py-name">isfile</tt><tt class="py-op">(</tt><tt id="link-470" class="py-name"><a title="p4vasp.db._currentDBI" class="py-name" href="#" onclick="return doclink('link-470', '_currentDBI', 'link-455');">_currentDBI</a></tt><tt class="py-op">)</tt><tt class="py-op">:</tt> </tt>
<a name="L834"></a><tt class="py-lineno">834</tt>  <tt class="py-line">        <tt id="link-471" class="py-name"><a title="p4vasp.db._currentDBI" class="py-name" href="#" onclick="return doclink('link-471', '_currentDBI', 'link-455');">_currentDBI</a></tt><tt class="py-op">=</tt><tt id="link-472" class="py-name" targets="Function p4vasp.db.createFromConfig()=p4vasp.db-module.html#createFromConfig"><a title="p4vasp.db.createFromConfig" class="py-name" href="#" onclick="return doclink('link-472', 'createFromConfig', 'link-472');">createFromConfig</a></tt><tt class="py-op">(</tt><tt class="py-op">[</tt><tt id="link-473" class="py-name"><a title="p4vasp.db._currentDBI" class="py-name" href="#" onclick="return doclink('link-473', '_currentDBI', 'link-455');">_currentDBI</a></tt><tt class="py-op">]</tt><tt class="py-op">)</tt> </tt>
<a name="L835"></a><tt class="py-lineno">835</tt>  <tt class="py-line">        <tt class="py-keyword">return</tt> <tt id="link-474" class="py-name"><a title="p4vasp.db._currentDBI" class="py-name" href="#" onclick="return doclink('link-474', '_currentDBI', 'link-455');">_currentDBI</a></tt> </tt>
<a name="L836"></a><tt class="py-lineno">836</tt>  <tt class="py-line"> </tt>
<a name="L837"></a><tt class="py-lineno">837</tt>  <tt class="py-line">    <tt class="py-name">f</tt><tt class="py-op">=</tt><tt class="py-name">open</tt><tt class="py-op">(</tt><tt id="link-475" class="py-name"><a title="p4vasp.db._currentDBI" class="py-name" href="#" onclick="return doclink('link-475', '_currentDBI', 'link-455');">_currentDBI</a></tt><tt class="py-op">,</tt><tt class="py-string">"w"</tt><tt class="py-op">)</tt> </tt>
<a name="L838"></a><tt class="py-lineno">838</tt>  <tt class="py-line">    <tt class="py-name">username</tt> <tt class="py-op">=</tt> <tt class="py-name">getuser</tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L839"></a><tt class="py-lineno">839</tt>  <tt class="py-line">    <tt class="py-name">uid</tt> <tt class="py-op">=</tt> <tt class="py-name">username</tt><tt class="py-op">+</tt><tt class="py-string">"_"</tt><tt class="py-op">+</tt><tt id="link-476" class="py-name"><a title="p4vasp.uuid" class="py-name" href="#" onclick="return doclink('link-476', 'uuid', 'link-457');">uuid</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">[</tt><tt class="py-number">1</tt><tt class="py-op">:</tt><tt class="py-op">-</tt><tt class="py-number">1</tt><tt class="py-op">]</tt> </tt>
<a name="L840"></a><tt class="py-lineno">840</tt>  <tt class="py-line">    <tt class="py-name">sqlitepath</tt><tt class="py-op">=</tt><tt class="py-name">os</tt><tt class="py-op">.</tt><tt id="link-477" class="py-name"><a title="p4vasp.Array.path
p4vasp.Dictionary.path
p4vasp.Structure.path
p4vasp.applet.Applet.path
p4vasp.message.path
p4vasp.repository.path
p4vasp.schedule'.path
p4vasp.store.path
p4vasp.util.path" class="py-name" href="#" onclick="return doclink('link-477', 'path', 'link-0');">path</a></tt><tt class="py-op">.</tt><tt class="py-name">join</tt><tt class="py-op">(</tt><tt id="link-478" class="py-name"><a title="p4vasp.getUserConfigurationDirectory" class="py-name" href="#" onclick="return doclink('link-478', 'getUserConfigurationDirectory', 'link-468');">getUserConfigurationDirectory</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">,</tt><tt class="py-string">"database.sqlite"</tt><tt class="py-op">)</tt> </tt>
<a name="L841"></a><tt class="py-lineno">841</tt>  <tt class="py-line">    <tt class="py-name">sqlitecreationscript</tt><tt class="py-op">=</tt> <tt class="py-name">os</tt><tt class="py-op">.</tt><tt id="link-479" class="py-name"><a title="p4vasp.Array.path
p4vasp.Dictionary.path
p4vasp.Structure.path
p4vasp.applet.Applet.path
p4vasp.message.path
p4vasp.repository.path
p4vasp.schedule'.path
p4vasp.store.path
p4vasp.util.path" class="py-name" href="#" onclick="return doclink('link-479', 'path', 'link-0');">path</a></tt><tt class="py-op">.</tt><tt class="py-name">join</tt><tt class="py-op">(</tt><tt id="link-480" class="py-name" targets="Variable p4vasp.Array.p4vasp_home=p4vasp.Array-module.html#p4vasp_home,Variable p4vasp.Dictionary.p4vasp_home=p4vasp.Dictionary-module.html#p4vasp_home,Variable p4vasp.GraphCanvas.p4vasp_home=p4vasp.GraphCanvas-module.html#p4vasp_home,Variable p4vasp.GraphPM.p4vasp_home=p4vasp.GraphPM-module.html#p4vasp_home,Variable p4vasp.Property.p4vasp_home=p4vasp.Property-module.html#p4vasp_home,Variable p4vasp.Structure.p4vasp_home=p4vasp.Structure-module.html#p4vasp_home,Variable p4vasp.graph.p4vasp_home=p4vasp.graph-module.html#p4vasp_home,Variable p4vasp.p4vasp_home=p4vasp-module.html#p4vasp_home,Variable p4vasp.repository.p4vasp_home=p4vasp.repository-module.html#p4vasp_home,Variable p4vasp.util.p4vasp_home=p4vasp.util-module.html#p4vasp_home"><a title="p4vasp.Array.p4vasp_home
p4vasp.Dictionary.p4vasp_home
p4vasp.GraphCanvas.p4vasp_home
p4vasp.GraphPM.p4vasp_home
p4vasp.Property.p4vasp_home
p4vasp.Structure.p4vasp_home
p4vasp.graph.p4vasp_home
p4vasp.p4vasp_home
p4vasp.repository.p4vasp_home
p4vasp.util.p4vasp_home" class="py-name" href="#" onclick="return doclink('link-480', 'p4vasp_home', 'link-480');">p4vasp_home</a></tt><tt class="py-op">,</tt><tt class="py-string">"data"</tt><tt class="py-op">,</tt><tt class="py-string">"database"</tt><tt class="py-op">,</tt><tt class="py-string">"tables_sqlite.sql"</tt><tt class="py-op">)</tt> </tt>
<a name="L842"></a><tt class="py-lineno">842</tt>  <tt class="py-line">    <tt class="py-name">mysqlcreationscript</tt><tt class="py-op">=</tt> <tt class="py-name">os</tt><tt class="py-op">.</tt><tt id="link-481" class="py-name"><a title="p4vasp.Array.path
p4vasp.Dictionary.path
p4vasp.Structure.path
p4vasp.applet.Applet.path
p4vasp.message.path
p4vasp.repository.path
p4vasp.schedule'.path
p4vasp.store.path
p4vasp.util.path" class="py-name" href="#" onclick="return doclink('link-481', 'path', 'link-0');">path</a></tt><tt class="py-op">.</tt><tt class="py-name">join</tt><tt class="py-op">(</tt><tt id="link-482" class="py-name"><a title="p4vasp.Array.p4vasp_home
p4vasp.Dictionary.p4vasp_home
p4vasp.GraphCanvas.p4vasp_home
p4vasp.GraphPM.p4vasp_home
p4vasp.Property.p4vasp_home
p4vasp.Structure.p4vasp_home
p4vasp.graph.p4vasp_home
p4vasp.p4vasp_home
p4vasp.repository.p4vasp_home
p4vasp.util.p4vasp_home" class="py-name" href="#" onclick="return doclink('link-482', 'p4vasp_home', 'link-480');">p4vasp_home</a></tt><tt class="py-op">,</tt><tt class="py-string">"data"</tt><tt class="py-op">,</tt><tt class="py-string">"database"</tt><tt class="py-op">,</tt><tt class="py-string">"tables_mysql.sql"</tt><tt class="py-op">)</tt> </tt>
<a name="L843"></a><tt class="py-lineno">843</tt>  <tt class="py-line">    <tt class="py-name">f</tt><tt class="py-op">.</tt><tt id="link-483" class="py-name" targets="Method p4vasp.Dictionary.Incar.write()=p4vasp.Dictionary.Incar-class.html#write,Method p4vasp.Structure.Structure.write()=p4vasp.Structure.Structure-class.html#write,Method p4vasp.SystemPM.SetupPM.write()=p4vasp.SystemPM.SetupPM-class.html#write,Method p4vasp.cStructure.Structure.write()=p4vasp.cStructure.Structure-class.html#write,Method p4vasp.cmatrix.Vector.write()=p4vasp.cmatrix.Vector-class.html#write,Method p4vasp.matrix.Vector.write()=p4vasp.matrix.Vector-class.html#write,Method p4vasp.message.DummyFile.write()=p4vasp.message.DummyFile-class.html#write,Method p4vasp.message.PrintFile.write()=p4vasp.message.PrintFile-class.html#write,Method p4vasp.paint3d.ColladaPaint3D.ColladaPaint3D.write()=p4vasp.paint3d.ColladaPaint3D.ColladaPaint3D-class.html#write,Method p4vasp.paint3d.OpenGLPaint3D.BasicOpenGLPaint3D.write()=p4vasp.paint3d.OpenGLPaint3D.BasicOpenGLPaint3D-class.html#write,Method p4vasp.paint3d.Paint3DInterface.Paint3DInterface.write()=p4vasp.paint3d.Paint3DInterface.Paint3DInterface-class.html#write,Method p4vasp.paint3d.PovrayPaint3D.ExtendedPovrayPaint3D.write()=p4vasp.paint3d.PovrayPaint3D.ExtendedPovrayPaint3D-class.html#write,Method p4vasp.paint3d.PovrayPaint3D.PovrayPaint3D.write()=p4vasp.paint3d.PovrayPaint3D.PovrayPaint3D-class.html#write,Method p4vasp.paint3d.PovrayPaint3D.PovrayPaint3DFrame.write()=p4vasp.paint3d.PovrayPaint3D.PovrayPaint3DFrame-class.html#write,Method p4vasp.store.AttributeProfile.write()=p4vasp.store.AttributeProfile-class.html#write,Method p4vasp.store.Profile.write()=p4vasp.store.Profile-class.html#write"><a title="p4vasp.Dictionary.Incar.write
p4vasp.Structure.Structure.write
p4vasp.SystemPM.SetupPM.write
p4vasp.cStructure.Structure.write
p4vasp.cmatrix.Vector.write
p4vasp.matrix.Vector.write
p4vasp.message.DummyFile.write
p4vasp.message.PrintFile.write
p4vasp.paint3d.ColladaPaint3D.ColladaPaint3D.write
p4vasp.paint3d.OpenGLPaint3D.BasicOpenGLPaint3D.write
p4vasp.paint3d.Paint3DInterface.Paint3DInterface.write
p4vasp.paint3d.PovrayPaint3D.ExtendedPovrayPaint3D.write
p4vasp.paint3d.PovrayPaint3D.PovrayPaint3D.write
p4vasp.paint3d.PovrayPaint3D.PovrayPaint3DFrame.write
p4vasp.store.AttributeProfile.write
p4vasp.store.Profile.write" class="py-name" href="#" onclick="return doclink('link-483', 'write', 'link-483');">write</a></tt><tt class="py-op">(</tt> </tt>
<a name="L844"></a><tt class="py-lineno">844</tt>  <tt class="py-line">    <tt class="py-string">"""</tt> </tt>
<a name="L845"></a><tt class="py-lineno">845</tt>  <tt class="py-line"><tt class="py-string">  [DEFAULT]</tt> </tt>
<a name="L846"></a><tt class="py-lineno">846</tt>  <tt class="py-line"><tt class="py-string">  # The following is the unique user id. It should be a string uniquely</tt> </tt>
<a name="L847"></a><tt class="py-lineno">847</tt>  <tt class="py-line"><tt class="py-string">  # identifying the user. The user_uid should be special enough, so that it will be</tt> </tt>
<a name="L848"></a><tt class="py-lineno">848</tt>  <tt class="py-line"><tt class="py-string">  # highly unlikely, that any other user will choose exactly the same id.</tt> </tt>
<a name="L849"></a><tt class="py-lineno">849</tt>  <tt class="py-line"><tt class="py-string">  # A good value could be e.g. an e-mail address (string derived from the e-mail address),</tt> </tt>
<a name="L850"></a><tt class="py-lineno">850</tt>  <tt class="py-line"><tt class="py-string">  # or possibly a combination of the name of the user and the instititute/company name.</tt> </tt>
<a name="L851"></a><tt class="py-lineno">851</tt>  <tt class="py-line"><tt class="py-string">  # Think of the user_uid as a long unique login name to all the p4vasp databases where you have access.</tt> </tt>
<a name="L852"></a><tt class="py-lineno">852</tt>  <tt class="py-line"><tt class="py-string">  # The given value was generated as a combination of your login name and a random string:</tt> </tt>
<a name="L853"></a><tt class="py-lineno">853</tt>  <tt class="py-line"><tt class="py-string"></tt> </tt>
<a name="L854"></a><tt class="py-lineno">854</tt>  <tt class="py-line"><tt class="py-string">  user_uid                : %s</tt> </tt>
<a name="L855"></a><tt class="py-lineno">855</tt>  <tt class="py-line"><tt class="py-string"></tt> </tt>
<a name="L856"></a><tt class="py-lineno">856</tt>  <tt class="py-line"><tt class="py-string">  # This will be the easy short name (nickname) to access the databases.</tt> </tt>
<a name="L857"></a><tt class="py-lineno">857</tt>  <tt class="py-line"><tt class="py-string">  # It should be the same in each database, unless there is a reason</tt> </tt>
<a name="L858"></a><tt class="py-lineno">858</tt>  <tt class="py-line"><tt class="py-string">  # to use a different username (e.g. if the username is already used).</tt> </tt>
<a name="L859"></a><tt class="py-lineno">859</tt>  <tt class="py-line"><tt class="py-string"></tt> </tt>
<a name="L860"></a><tt class="py-lineno">860</tt>  <tt class="py-line"><tt class="py-string">  username                : %s</tt> </tt>
<a name="L861"></a><tt class="py-lineno">861</tt>  <tt class="py-line"><tt class="py-string"></tt> </tt>
<a name="L862"></a><tt class="py-lineno">862</tt>  <tt class="py-line"><tt class="py-string">  # Table names. No need to change them.</tt> </tt>
<a name="L863"></a><tt class="py-lineno">863</tt>  <tt class="py-line"><tt class="py-string"></tt> </tt>
<a name="L864"></a><tt class="py-lineno">864</tt>  <tt class="py-line"><tt class="py-string">  table_userinfo          : userinfo</tt> </tt>
<a name="L865"></a><tt class="py-lineno">865</tt>  <tt class="py-line"><tt class="py-string">  table_calc              : calc</tt> </tt>
<a name="L866"></a><tt class="py-lineno">866</tt>  <tt class="py-line"><tt class="py-string">  table_parameters        : parameters</tt> </tt>
<a name="L867"></a><tt class="py-lineno">867</tt>  <tt class="py-line"><tt class="py-string">  table_struct            : struct</tt> </tt>
<a name="L868"></a><tt class="py-lineno">868</tt>  <tt class="py-line"><tt class="py-string">  table_energy            : energy</tt> </tt>
<a name="L869"></a><tt class="py-lineno">869</tt>  <tt class="py-line"><tt class="py-string">  table_structpos         : structpos</tt> </tt>
<a name="L870"></a><tt class="py-lineno">870</tt>  <tt class="py-line"><tt class="py-string">  table_structforce       : structforce</tt> </tt>
<a name="L871"></a><tt class="py-lineno">871</tt>  <tt class="py-line"><tt class="py-string">  table_structvelocity    : structvelocity</tt> </tt>
<a name="L872"></a><tt class="py-lineno">872</tt>  <tt class="py-line"><tt class="py-string">  table_structconstraints : structconstraints</tt> </tt>
<a name="L873"></a><tt class="py-lineno">873</tt>  <tt class="py-line"><tt class="py-string">  table_dos               : dos</tt> </tt>
<a name="L874"></a><tt class="py-lineno">874</tt>  <tt class="py-line"><tt class="py-string">  table_ldos              : ldos</tt> </tt>
<a name="L875"></a><tt class="py-lineno">875</tt>  <tt class="py-line"><tt class="py-string"></tt> </tt>
<a name="L876"></a><tt class="py-lineno">876</tt>  <tt class="py-line"><tt class="py-string">  # Each section (starting by a name in the square brackets) is a configuration for one database.</tt> </tt>
<a name="L877"></a><tt class="py-lineno">877</tt>  <tt class="py-line"><tt class="py-string">  # Now there is just one - the "Local database":</tt> </tt>
<a name="L878"></a><tt class="py-lineno">878</tt>  <tt class="py-line"><tt class="py-string"></tt> </tt>
<a name="L879"></a><tt class="py-lineno">879</tt>  <tt class="py-line"><tt class="py-string">  [Local database]</tt> </tt>
<a name="L880"></a><tt class="py-lineno">880</tt>  <tt class="py-line"><tt class="py-string"></tt> </tt>
<a name="L881"></a><tt class="py-lineno">881</tt>  <tt class="py-line"><tt class="py-string">  # This is a database type (or database driver).</tt> </tt>
<a name="L882"></a><tt class="py-lineno">882</tt>  <tt class="py-line"><tt class="py-string"></tt> </tt>
<a name="L883"></a><tt class="py-lineno">883</tt>  <tt class="py-line"><tt class="py-string">  type                    : sqlite</tt> </tt>
<a name="L884"></a><tt class="py-lineno">884</tt>  <tt class="py-line"><tt class="py-string"></tt> </tt>
<a name="L885"></a><tt class="py-lineno">885</tt>  <tt class="py-line"><tt class="py-string">  # Path to a file, where the sqlite database should be stored.</tt> </tt>
<a name="L886"></a><tt class="py-lineno">886</tt>  <tt class="py-line"><tt class="py-string">  # Usually it does not work, if the file is on a file server.  &lt;------------ IMPORTANT !!!</tt> </tt>
<a name="L887"></a><tt class="py-lineno">887</tt>  <tt class="py-line"><tt class="py-string">  # Point the path to a file on a local disk:</tt> </tt>
<a name="L888"></a><tt class="py-lineno">888</tt>  <tt class="py-line"><tt class="py-string"></tt> </tt>
<a name="L889"></a><tt class="py-lineno">889</tt>  <tt class="py-line"><tt class="py-string">  path                    : %s</tt> </tt>
<a name="L890"></a><tt class="py-lineno">890</tt>  <tt class="py-line"><tt class="py-string"></tt> </tt>
<a name="L891"></a><tt class="py-lineno">891</tt>  <tt class="py-line"><tt class="py-string">  # Don't change this unless you know, what are you doing.</tt> </tt>
<a name="L892"></a><tt class="py-lineno">892</tt>  <tt class="py-line"><tt class="py-string">  creation_script         : %s</tt> </tt>
<a name="L893"></a><tt class="py-lineno">893</tt>  <tt class="py-line"><tt class="py-string"></tt> </tt>
<a name="L894"></a><tt class="py-lineno">894</tt>  <tt class="py-line"><tt class="py-string">  # If you want to use mysql, uncomment and edit the following lines:</tt> </tt>
<a name="L895"></a><tt class="py-lineno">895</tt>  <tt class="py-line"><tt class="py-string"></tt> </tt>
<a name="L896"></a><tt class="py-lineno">896</tt>  <tt class="py-line"><tt class="py-string">  #[MySQL]</tt> </tt>
<a name="L897"></a><tt class="py-lineno">897</tt>  <tt class="py-line"><tt class="py-string">  #</tt> </tt>
<a name="L898"></a><tt class="py-lineno">898</tt>  <tt class="py-line"><tt class="py-string">  #commit                  : enabled</tt> </tt>
<a name="L899"></a><tt class="py-lineno">899</tt>  <tt class="py-line"><tt class="py-string">  #</tt> </tt>
<a name="L900"></a><tt class="py-lineno">900</tt>  <tt class="py-line"><tt class="py-string">  #type                    : mysql</tt> </tt>
<a name="L901"></a><tt class="py-lineno">901</tt>  <tt class="py-line"><tt class="py-string">  #default_commit          : disabled</tt> </tt>
<a name="L902"></a><tt class="py-lineno">902</tt>  <tt class="py-line"><tt class="py-string">  #db_user                 : p4vasp</tt> </tt>
<a name="L903"></a><tt class="py-lineno">903</tt>  <tt class="py-line"><tt class="py-string">  #db_password             : p4vasp</tt> </tt>
<a name="L904"></a><tt class="py-lineno">904</tt>  <tt class="py-line"><tt class="py-string">  #db_database             : p4vasp</tt> </tt>
<a name="L905"></a><tt class="py-lineno">905</tt>  <tt class="py-line"><tt class="py-string">  #db_host                 : localhost</tt> </tt>
<a name="L906"></a><tt class="py-lineno">906</tt>  <tt class="py-line"><tt class="py-string">  #</tt> </tt>
<a name="L907"></a><tt class="py-lineno">907</tt>  <tt class="py-line"><tt class="py-string">  #creation_script         : %s</tt> </tt>
<a name="L908"></a><tt class="py-lineno">908</tt>  <tt class="py-line"><tt class="py-string"></tt> </tt>
<a name="L909"></a><tt class="py-lineno">909</tt>  <tt class="py-line"><tt class="py-string">  """</tt><tt class="py-op">%</tt><tt class="py-op">(</tt><tt class="py-name">uid</tt><tt class="py-op">,</tt><tt class="py-name">username</tt><tt class="py-op">,</tt><tt class="py-name">sqlitepath</tt><tt class="py-op">,</tt><tt class="py-name">sqlitecreationscript</tt><tt class="py-op">,</tt><tt class="py-name">mysqlcreationscript</tt><tt class="py-op">)</tt><tt class="py-op">)</tt> </tt>
<a name="L910"></a><tt class="py-lineno">910</tt>  <tt class="py-line">    <tt class="py-name">f</tt><tt class="py-op">.</tt><tt id="link-484" class="py-name"><a title="p4vasp.GraphCanvas.GraphCanvasWindow.close
p4vasp.GraphCanvas_gtk1.GraphCanvasWindow.close
p4vasp.message.DummyFile.close
p4vasp.message.PrintFile.close" class="py-name" href="#" onclick="return doclink('link-484', 'close', 'link-60');">close</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt> </tt>
<a name="L911"></a><tt class="py-lineno">911</tt>  <tt class="py-line"> </tt>
<a name="L912"></a><tt class="py-lineno">912</tt>  <tt class="py-line">    <tt id="link-485" class="py-name"><a title="p4vasp.msg" class="py-name" href="#" onclick="return doclink('link-485', 'msg', 'link-137');">msg</a></tt><tt class="py-op">(</tt><tt class="py-op">)</tt><tt class="py-op">.</tt><tt id="link-486" class="py-name" targets="Method p4vasp.message.MessageDriver.confirm()=p4vasp.message.MessageDriver-class.html#confirm"><a title="p4vasp.message.MessageDriver.confirm" class="py-name" href="#" onclick="return doclink('link-486', 'confirm', 'link-486');">confirm</a></tt><tt class="py-op">(</tt> </tt>
<a name="L913"></a><tt class="py-lineno">913</tt>  <tt class="py-line">  <tt class="py-string">"""</tt> </tt>
<a name="L914"></a><tt class="py-lineno">914</tt>  <tt class="py-line"><tt class="py-string">  The database configuration file was created in</tt> </tt>
<a name="L915"></a><tt class="py-lineno">915</tt>  <tt class="py-line"><tt class="py-string">  %s.</tt> </tt>
<a name="L916"></a><tt class="py-lineno">916</tt>  <tt class="py-line"><tt class="py-string">  Please, edit this file and restart p4vasp.</tt> </tt>
<a name="L917"></a><tt class="py-lineno">917</tt>  <tt class="py-line"><tt class="py-string">  """</tt><tt class="py-op">%</tt><tt id="link-487" class="py-name"><a title="p4vasp.db._currentDBI" class="py-name" href="#" onclick="return doclink('link-487', '_currentDBI', 'link-455');">_currentDBI</a></tt><tt class="py-op">)</tt> </tt>
<a name="L918"></a><tt class="py-lineno">918</tt>  <tt class="py-line"> </tt>
<a name="L919"></a><tt class="py-lineno">919</tt>  <tt class="py-line">    <tt class="py-keyword">return</tt> <tt class="py-name">None</tt> </tt>
</div><a name="L920"></a><tt class="py-lineno">920</tt>  <tt class="py-line"> </tt>
<a name="L921"></a><tt class="py-lineno">921</tt>  <tt class="py-line"> </tt>
<a name="L922"></a><tt class="py-lineno">922</tt>  <tt class="py-line"><tt class="py-comment">#if __name__=="__main__":</tt> </tt>
<a name="L923"></a><tt class="py-lineno">923</tt>  <tt class="py-line"><tt class="py-comment">#  import p4vasp.SystemPM as pm</tt> </tt>
<a name="L924"></a><tt class="py-lineno">924</tt>  <tt class="py-line"><tt class="py-comment">#  d=createFromConfig(["tables.cfg"],mixin=P4VMixin)</tt> </tt>
<a name="L925"></a><tt class="py-lineno">925</tt>  <tt class="py-line"><tt class="py-comment">#  d.connect()</tt> </tt>
<a name="L926"></a><tt class="py-lineno">926</tt>  <tt class="py-line"><tt class="py-comment">#  cmd=open("tables1.sql").read()</tt> </tt>
<a name="L927"></a><tt class="py-lineno">927</tt>  <tt class="py-line"><tt class="py-comment">#  d.run(cmd,ignore_errors=1)</tt> </tt>
<a name="L928"></a><tt class="py-lineno">928</tt>  <tt class="py-line"><tt class="py-comment">#</tt> </tt>
<a name="L929"></a><tt class="py-lineno">929</tt>  <tt class="py-line"><tt class="py-comment">#  d[0].addUser()</tt> </tt>
<a name="L930"></a><tt class="py-lineno">930</tt>  <tt class="py-line"><tt class="py-comment">#  s=pm.XMLSystemPM("vasprun.xml")</tt> </tt>
<a name="L931"></a><tt class="py-lineno">931</tt>  <tt class="py-line"><tt class="py-comment">#  d[0].storePM(s)</tt> </tt>
<a name="L932"></a><tt class="py-lineno">932</tt>  <tt class="py-line"> </tt><script type="text/javascript">
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